ethyl 1-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-cyclopentyltetrazol-5-yl)-(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[(1-cyclopentyl-5-tetrazolyl)-(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-cyclopentyltetrazol-5-yl)-(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(1-cyclopentyltetrazol-5-yl)-(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]isonipecotic acid ethyl ester Formula: C26H34N6O4 MolecularWeight: 494.58596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCC4)N5CCC(CC5)C(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C4CCCC4)N5CCC(CC5)C(=O)OCC

InChI

InChI=1S/C26H34N6O4/c1-3-35-20-9-10-22-18(15-20)16-21(25(33)27-22)23(24-28-29-30-32(24)19-7-5-6-8-19)31-13-11-17(12-14-31)26(34)36-4-2/h9-10,15-17,19,23H,3-8,11-14H2,1-2H3,(H,27,33)