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

Systemtic Name: 2-methoxy-5-[[4-[5-methoxy-1-(thiophen-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[4-[5-methoxy-1-(2-thienylmethyl)indol-3-yl]-1-piperidyl]methyl]benzoic acid CAS Name: 2-methoxy-5-[[4-[5-methoxy-1-(thiophen-2-ylmethyl)-3-indolyl]-1-piperidinyl]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[4-[5-methoxy-1-(thiophen-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[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=CC2=C(C=C1)N(C=C2C3CCN(CC3)CC4=CC(=C(C=C4)OC)C(=O)O)CC5=CC=CS5

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2C3CCN(CC3)CC4=CC(=C(C=C4)OC)C(=O)O)CC5=CC=CS5

InChI

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