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

Systemtic Name: ethyl 1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-tert-butyltetrazol-5-yl)-(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[(1-tert-butyl-5-tetrazolyl)-(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-tert-butyltetrazol-5-yl)-(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(1-tert-butyltetrazol-5-yl)-(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]isonipecotic acid ethyl ester Formula: C25H34N6O3 MolecularWeight: 466.57586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C(C)(C)C)N4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C(C)(C)C)N4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C25H34N6O3/c1-6-16-8-9-20-18(14-16)15-19(23(32)26-20)21(22-27-28-29-31(22)25(3,4)5)30-12-10-17(11-13-30)24(33)34-7-2/h8-9,14-15,17,21H,6-7,10-13H2,1-5H3,(H,26,32)