methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-[3-phenyl-2-(phenylsulfonyl)propyl]indole-5-carboxylate

Systemtic Name: methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-[3-phenyl-2-(phenylsulfonyl)propyl]indole-5-carboxylate Openeye Name: methyl 1-[2-(benzenesulfonyl)-3-phenyl-propyl]-3-[(2-hydroxyanilino)methyl]indole-5-carboxylate CAS Name: 1-[2-(benzenesulfonyl)-3-phenylpropyl]-3-[(2-hydroxyanilino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(benzenesulfonyl)-3-phenylpropyl]-3-[(2-hydroxyanilino)methyl]indole-5-carboxylate Traditional Name: 1-(2-besyl-3-phenyl-propyl)-3-[(2-hydroxyanilino)methyl]indole-5-carboxylic acid methyl ester Formula: C32H30N2O5S MolecularWeight: 554.656

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=C2CNC3=CC=CC=C3O)CC(CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=C2CNC3=CC=CC=C3O)CC(CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H30N2O5S/c1-39-32(36)24-16-17-30-28(19-24)25(20-33-29-14-8-9-15-31(29)35)21-34(30)22-27(18-23-10-4-2-5-11-23)40(37,38)26-12-6-3-7-13-26/h2-17,19,21,27,33,35H,18,20,22H2,1H3