methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-[4-methyl-2-(phenylsulfonyl)pentyl]indole-5-carboxylate

Systemtic Name: methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-[4-methyl-2-(phenylsulfonyl)pentyl]indole-5-carboxylate Openeye Name: methyl 1-[2-(benzenesulfonyl)-4-methyl-pentyl]-3-[(2-hydroxyanilino)methyl]indole-5-carboxylate CAS Name: 1-[2-(benzenesulfonyl)-4-methylpentyl]-3-[(2-hydroxyanilino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(benzenesulfonyl)-4-methylpentyl]-3-[(2-hydroxyanilino)methyl]indole-5-carboxylate Traditional Name: 1-(2-besyl-4-methyl-pentyl)-3-[(2-hydroxyanilino)methyl]indole-5-carboxylic acid methyl ester Formula: C29H32N2O5S MolecularWeight: 520.63978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNC3=CC=CC=C3O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNC3=CC=CC=C3O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O5S/c1-20(2)15-24(37(34,35)23-9-5-4-6-10-23)19-31-18-22(17-30-26-11-7-8-12-28(26)32)25-16-21(29(33)36-3)13-14-27(25)31/h4-14,16,18,20,24,30,32H,15,17,19H2,1-3H3