[2-(3-cyclopentyloxy-4-methoxy-phenyl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)inden-5-yl] 1-piperidin-4-ylpiperidine-4-carboxylate

Systemtic Name: [2-(3-cyclopentyloxy-4-methoxy-phenyl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)inden-5-yl] 1-piperidin-4-ylpiperidine-4-carboxylate Openeye Name: [2-[3-(cyclopentoxy)-4-methoxy-phenyl]-1,3-dioxo-2-(4-pyridylmethyl)indan-5-yl] 1-(4-piperidyl)piperidine-4-carboxylate CAS Name: 1-(4-piperidinyl)-4-piperidinecarboxylic acid [2-(3-cyclopentyloxy-4-methoxyphenyl)-1,3-dioxo-2-(pyridin-4-ylmethyl)-5-indenyl] ester IUPAC Name: [2-(3-cyclopentyloxy-4-methoxyphenyl)-1,3-dioxo-2-(pyridin-4-ylmethyl)inden-5-yl] 1-piperidin-4-ylpiperidine-4-carboxylate Traditional Name: 1-(4-piperidyl)isonipecotic acid [2-[3-(cyclopentoxy)-4-methoxy-phenyl]-1,3-diketo-2-(4-pyridylmethyl)indan-5-yl] ester Formula: C38H43N3O6 MolecularWeight: 637.76452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(C(=O)C3=C(C2=O)C=C(C=C3)OC(=O)C4CCN(CC4)C5CCNCC5)CC6=CC=NC=C6)OC7CCCC7

Isomeric SMILES

COC1=C(C=C(C=C1)C2(C(=O)C3=C(C2=O)C=C(C=C3)OC(=O)C4CCN(CC4)C5CCNCC5)CC6=CC=NC=C6)OC7CCCC7

InChI

InChI=1S/C38H43N3O6/c1-45-33-9-6-27(22-34(33)46-29-4-2-3-5-29)38(24-25-10-16-39-17-11-25)35(42)31-8-7-30(23-32(31)36(38)43)47-37(44)26-14-20-41(21-15-26)28-12-18-40-19-13-28/h6-11,16-17,22-23,26,28-29,40H,2-5,12-15,18-21,24H2,1H3