1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-propan-2-ylphenyl)indole-2-carboxylic acid

Systemtic Name: 1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-propan-2-ylphenyl)indole-2-carboxylic acid Openeye Name: 1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-isopropylphenyl)indole-2-carboxylic acid CAS Name: 1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-propan-2-ylphenyl)-2-indolecarboxylic acid IUPAC Name: 1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-propan-2-ylphenyl)indole-2-carboxylic acid Traditional Name: 1-[3-(cyclopropylmethoxy)benzyl]-3-m-cumenyl-indole-2-carboxylic acid Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1)C2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)OCC5CC5)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC(=C1)C2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)OCC5CC5)C(=O)O

InChI

InChI=1S/C29H29NO3/c1-19(2)22-8-6-9-23(16-22)27-25-11-3-4-12-26(25)30(28(27)29(31)32)17-21-7-5-10-24(15-21)33-18-20-13-14-20/h3-12,15-16,19-20H,13-14,17-18H2,1-2H3,(H,31,32)