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

Systemtic Name: methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-(3-phenyl-2-propan-2-ylsulfonyl-propyl)indole-5-carboxylate Openeye Name: methyl 3-[(2-hydroxyanilino)methyl]-1-(2-isopropylsulfonyl-3-phenyl-propyl)indole-5-carboxylate CAS Name: 3-[(2-hydroxyanilino)methyl]-1-(3-phenyl-2-propan-2-ylsulfonylpropyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-hydroxyanilino)methyl]-1-(3-phenyl-2-propan-2-ylsulfonylpropyl)indole-5-carboxylate Traditional Name: 3-[(2-hydroxyanilino)methyl]-1-(2-isopropylsulfonyl-3-phenyl-propyl)indole-5-carboxylic acid methyl ester Formula: C29H32N2O5S MolecularWeight: 520.63978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNC4=CC=CC=C4O

Isomeric SMILES

CC(C)S(=O)(=O)C(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNC4=CC=CC=C4O

InChI

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