3-(4-chlorophenyl)-2-methyl-8-(1,3-oxazinan-3-ium-3-ylmethyl)-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-methyl-8-(1,3-oxazinan-3-ium-3-ylmethyl)-7-oxidanyl-chromen-4-one Openeye Name: 3-(4-chlorophenyl)-7-hydroxy-2-methyl-8-(1,3-oxazinan-3-ium-3-ylmethyl)chromen-4-one CAS Name: 3-(4-chlorophenyl)-7-hydroxy-2-methyl-8-(1,3-oxazinan-3-ium-3-ylmethyl)-1-benzopyran-4-one IUPAC Name: 3-(4-chlorophenyl)-7-hydroxy-2-methyl-8-(1,3-oxazinan-3-ium-3-ylmethyl)chromen-4-one Traditional Name: 3-(4-chlorophenyl)-7-hydroxy-2-methyl-8-(1,3-oxazinan-3-ium-3-ylmethyl)chromone Formula: C21H21ClNO4+ MolecularWeight: 386.84874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+]3CCCOC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+]3CCCOC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClNO4/c1-13-19(14-3-5-15(22)6-4-14)20(25)16-7-8-18(24)17(21(16)27-13)11-23-9-2-10-26-12-23/h3-8,24H,2,9-12H2,1H3/p+1