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

Systemtic Name: 4-methoxy-2-[[4-[5-methoxy-1-(thiophen-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid Openeye Name: 4-methoxy-2-[[4-[5-methoxy-1-(2-thienylmethyl)indol-3-yl]-1-piperidyl]methyl]benzoic acid CAS Name: 4-methoxy-2-[[4-[5-methoxy-1-(thiophen-2-ylmethyl)-3-indolyl]-1-piperidinyl]methyl]benzoic acid IUPAC Name: 4-methoxy-2-[[4-[5-methoxy-1-(thiophen-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid Traditional Name: 4-methoxy-2-[[4-[5-methoxy-1-(2-thenyl)indol-3-yl]piperidino]methyl]benzoic acid Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)O)CN2CCC(CC2)C3=CN(C4=C3C=C(C=C4)OC)CC5=CC=CS5

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)O)CN2CCC(CC2)C3=CN(C4=C3C=C(C=C4)OC)CC5=CC=CS5

InChI

InChI=1S/C28H30N2O4S/c1-33-21-5-7-24(28(31)32)20(14-21)16-29-11-9-19(10-12-29)26-18-30(17-23-4-3-13-35-23)27-8-6-22(34-2)15-25(26)27/h3-8,13-15,18-19H,9-12,16-17H2,1-2H3,(H,31,32)