[3-bromanyl-5-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)-2-oxidanyl-phenyl]carbamic acid

Systemtic Name: [3-bromanyl-5-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)-2-oxidanyl-phenyl]carbamic acid Openeye Name: [3-bromo-5-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)-2-hydroxy-phenyl]carbamic acid CAS Name: [3-bromo-5-(9-bromo-2,3-dimethyl-4-benzo[f][1]benzothiolyl)-2-hydroxyphenyl]carbamic acid IUPAC Name: [3-bromo-5-(9-bromo-2,3-dimethylbenzo[f][1]benzothiol-4-yl)-2-hydroxyphenyl]carbamic acid Traditional Name: [3-bromo-5-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)-2-hydroxy-phenyl]carbamic acid Formula: C21H15Br2NO3S MolecularWeight: 521.2217

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=CC(=C(C(=C4)Br)O)NC(=O)O)Br)C

Isomeric SMILES

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=CC(=C(C(=C4)Br)O)NC(=O)O)Br)C

InChI

InChI=1S/C21H15Br2NO3S/c1-9-10(2)28-20-16(9)17(12-5-3-4-6-13(12)18(20)23)11-7-14(22)19(25)15(8-11)24-21(26)27/h3-8,24-25H,1-2H3,(H,26,27)