3-[[4-[1-(1-cyclopropylethyl)indol-3-yl]piperidin-1-yl]methyl]-2-methoxy-benzoic acid

Systemtic Name: 3-[[4-[1-(1-cyclopropylethyl)indol-3-yl]piperidin-1-yl]methyl]-2-methoxy-benzoic acid Openeye Name: 3-[[4-[1-(1-cyclopropylethyl)indol-3-yl]-1-piperidyl]methyl]-2-methoxy-benzoic acid CAS Name: 3-[[4-[1-(1-cyclopropylethyl)-3-indolyl]-1-piperidinyl]methyl]-2-methoxybenzoic acid IUPAC Name: 3-[[4-[1-(1-cyclopropylethyl)indol-3-yl]piperidin-1-yl]methyl]-2-methoxybenzoic acid Traditional Name: 3-[[4-[1-(1-cyclopropylethyl)indol-3-yl]piperidino]methyl]-2-methoxy-benzoic acid Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N2C=C(C3=CC=CC=C32)C4CCN(CC4)CC5=CC=CC(=C5OC)C(=O)O

Isomeric SMILES

CC(C1CC1)N2C=C(C3=CC=CC=C32)C4CCN(CC4)CC5=CC=CC(=C5OC)C(=O)O

InChI

InChI=1S/C27H32N2O3/c1-18(19-10-11-19)29-17-24(22-7-3-4-9-25(22)29)20-12-14-28(15-13-20)16-21-6-5-8-23(27(30)31)26(21)32-2/h3-9,17-20H,10-16H2,1-2H3,(H,30,31)