ethyl 1-[3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-keto-1,2,3-benzotriazin-3-yl)propanoyl]isonipecotic acid ethyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H22N4O4/c1-2-26-18(25)13-7-10-21(11-8-13)16(23)9-12-22-17(24)14-5-3-4-6-15(14)19-20-22/h3-6,13H,2,7-12H2,1H3