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4-[3-[3,5-bis(bromanyl)-2-methyl-4-oxidanyl-phenyl]-1,1-bis(oxidanylidene)-2,1$l^{6}-benzoxathiol-3-yl]-2,6-bis(bromanyl)-3-methyl-phenol; 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline

4-[3-[3,5-bis(bromanyl)-2-methyl-4-oxidanyl-phenyl]-1,1-bis(oxidanylidene)-2,1$l^{6}-benzoxathiol-3-yl]-2,6-bis(bromanyl)-3-methyl-phenol; 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline

Systemtic Name:4-[3-[3,5-bis(bromanyl)-2-methyl-4-oxidanyl-phenyl]-1,1-bis(oxidanylidene)-2,1$l^{6}-benzoxathiol-3-yl]-2,6-bis(bromanyl)-3-methyl-phenol; 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline
Openeye Name:2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxy-2-methyl-phenyl)-1,1-dioxo-2,1$l^{6}-benzoxathiol-3-yl]-3-methyl-phenol; 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline
CAS Name:2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxy-2-methylphenyl)-1,1-dioxo-2,1$l^{6}-benzoxathiol-3-yl]-3-methylphenol; 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline
IUPAC Name:2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxy-2-methylphenyl)-1,1-dioxo-2,1$l^{6}-benzoxathiol-3-yl]-3-methylphenol; 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline
Traditional Name:2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxy-2-methyl-phenyl)-1,1-diketo-2,1$l^{6}-benzoxathiol-3-yl]-3-methyl-phenol; 6,7-dimethoxy-1-veratryl-isoquinoline
Formula: C41H35Br4NO9S
MolecularWeight: 1037.3989
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)O)Br)Br)O)Br.COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC


Isomeric SMILES

CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)O)Br)Br)O)Br.COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC


InChI

InChI=1S/C21H14Br4O5S.C20H21NO4/c1-9-12(7-14(22)19(26)17(9)24)21(13-8-15(23)20(27)18(25)10(13)2)11-5-3-4-6-16(11)31(28,29)30-21;1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h3-8,26-27H,1-2H3;5-8,10-12H,9H2,1-4H3


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