3-[3-oxidanylidene-3-[2-(4-propan-2-ylphenyl)ethylamino]propyl]-1-phenyl-indole-5-carboxylic acid

Systemtic Name: 3-[3-oxidanylidene-3-[2-(4-propan-2-ylphenyl)ethylamino]propyl]-1-phenyl-indole-5-carboxylic acid Openeye Name: 3-[3-[2-(4-isopropylphenyl)ethylamino]-3-oxo-propyl]-1-phenyl-indole-5-carboxylic acid CAS Name: 3-[3-oxo-3-[2-(4-propan-2-ylphenyl)ethylamino]propyl]-1-phenyl-5-indolecarboxylic acid IUPAC Name: 3-[3-oxo-3-[2-(4-propan-2-ylphenyl)ethylamino]propyl]-1-phenylindole-5-carboxylic acid Traditional Name: 3-[3-keto-3-(2-p-cumenylethylamino)propyl]-1-phenyl-indole-5-carboxylic acid Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCNC(=O)CCC2=CN(C3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCNC(=O)CCC2=CN(C3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C29H30N2O3/c1-20(2)22-10-8-21(9-11-22)16-17-30-28(32)15-13-24-19-31(25-6-4-3-5-7-25)27-14-12-23(29(33)34)18-26(24)27/h3-12,14,18-20H,13,15-17H2,1-2H3,(H,30,32)(H,33,34)