(phenylmethyl) 1,10-dimethyl-9-(4-methylphenyl)sulfonyl-3H-pyrrolo[3,2-b]carbazole-2-carboxylate

Systemtic Name: (phenylmethyl) 1,10-dimethyl-9-(4-methylphenyl)sulfonyl-3H-pyrrolo[3,2-b]carbazole-2-carboxylate Openeye Name: benzyl 1,10-dimethyl-9-(p-tolylsulfonyl)-3H-pyrrolo[3,2-b]carbazole-2-carboxylate CAS Name: 1,10-dimethyl-9-(4-methylphenyl)sulfonyl-3H-pyrrolo[3,2-b]carbazole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1,10-dimethyl-9-(4-methylphenyl)sulfonyl-3H-pyrrolo[3,2-b]carbazole-2-carboxylate Traditional Name: 1,10-dimethyl-9-tosyl-3H-pyrrolo[3,2-b]carbazole-2-carboxylic acid benzyl ester Formula: C31H26N2O4S MolecularWeight: 522.61414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C4=CC5=C(C(=C42)C)C(=C(N5)C(=O)OCC6=CC=CC=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C4=CC5=C(C(=C42)C)C(=C(N5)C(=O)OCC6=CC=CC=C6)C

InChI

InChI=1S/C31H26N2O4S/c1-19-13-15-23(16-14-19)38(35,36)33-27-12-8-7-11-24(27)25-17-26-28(21(3)30(25)33)20(2)29(32-26)31(34)37-18-22-9-5-4-6-10-22/h4-17,32H,18H2,1-3H3