3-(4-tert-butylphenyl)-5-(cyclopropylmethoxymethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-5-(cyclopropylmethoxymethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-5-(cyclopropylmethoxymethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-5-(cyclopropylmethoxymethyl)-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-5-(cyclopropylmethoxymethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-5-(cyclopropylmethoxymethyl)-1-m-anisyl-indole-2-carboxylic acid Formula: C32H35NO4 MolecularWeight: 497.6246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)COCC4CC4)CC5=CC(=CC=C5)OC)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)COCC4CC4)CC5=CC(=CC=C5)OC)C(=O)O

InChI

InChI=1S/C32H35NO4/c1-32(2,3)25-13-11-24(12-14-25)29-27-17-23(20-37-19-21-8-9-21)10-15-28(27)33(30(29)31(34)35)18-22-6-5-7-26(16-22)36-4/h5-7,10-17,21H,8-9,18-20H2,1-4H3,(H,34,35)