3-[[4-[1-(2-ethoxyethyl)-5-methoxy-indol-3-yl]piperidin-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[4-[1-(2-ethoxyethyl)-5-methoxy-indol-3-yl]piperidin-1-yl]methyl]benzoic acid Openeye Name: 3-[[4-[1-(2-ethoxyethyl)-5-methoxy-indol-3-yl]-1-piperidyl]methyl]benzoic acid CAS Name: 3-[[4-[1-(2-ethoxyethyl)-5-methoxy-3-indolyl]-1-piperidinyl]methyl]benzoic acid IUPAC Name: 3-[[4-[1-(2-ethoxyethyl)-5-methoxyindol-3-yl]piperidin-1-yl]methyl]benzoic acid Traditional Name: 3-[[4-[1-(2-ethoxyethyl)-5-methoxy-indol-3-yl]piperidino]methyl]benzoic acid Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=C1C=CC(=C2)OC)C3CCN(CC3)CC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=C1C=CC(=C2)OC)C3CCN(CC3)CC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C26H32N2O4/c1-3-32-14-13-28-18-24(23-16-22(31-2)7-8-25(23)28)20-9-11-27(12-10-20)17-19-5-4-6-21(15-19)26(29)30/h4-8,15-16,18,20H,3,9-14,17H2,1-2H3,(H,29,30)