1-(cyclopropylmethyl)-3-[(4-methoxyphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 1-(cyclopropylmethyl)-3-[(4-methoxyphenyl)methyl]indole-2-carboxylic acid Openeye Name: 1-(cyclopropylmethyl)-3-[(4-methoxyphenyl)methyl]indole-2-carboxylic acid CAS Name: 1-(cyclopropylmethyl)-3-[(4-methoxyphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 1-(cyclopropylmethyl)-3-[(4-methoxyphenyl)methyl]indole-2-carboxylic acid Traditional Name: 1-(cyclopropylmethyl)-3-p-anisyl-indole-2-carboxylic acid Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(N(C3=CC=CC=C32)CC4CC4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(N(C3=CC=CC=C32)CC4CC4)C(=O)O

InChI

InChI=1S/C21H21NO3/c1-25-16-10-8-14(9-11-16)12-18-17-4-2-3-5-19(17)22(13-15-6-7-15)20(18)21(23)24/h2-5,8-11,15H,6-7,12-13H2,1H3,(H,23,24)