N-[2-(benzotriazol-1-yl)ethyl]-6-oxidanylidene-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide

Systemtic Name: N-[2-(benzotriazol-1-yl)ethyl]-6-oxidanylidene-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide Openeye Name: N-[2-(benzotriazol-1-yl)ethyl]-6-oxo-1-(2-pyridylmethyl)piperidine-3-carboxamide CAS Name: N-[2-(1-benzotriazolyl)ethyl]-6-oxo-1-(2-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: N-[2-(benzotriazol-1-yl)ethyl]-6-oxo-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide Traditional Name: N-[2-(benzotriazol-1-yl)ethyl]-6-keto-1-(2-pyridylmethyl)nipecotamide Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCCN2C3=CC=CC=C3N=N2)CC4=CC=CC=N4

Isomeric SMILES

C1CC(=O)N(CC1C(=O)NCCN2C3=CC=CC=C3N=N2)CC4=CC=CC=N4

InChI

InChI=1S/C20H22N6O2/c27-19-9-8-15(13-25(19)14-16-5-3-4-10-21-16)20(28)22-11-12-26-18-7-2-1-6-17(18)23-24-26/h1-7,10,15H,8-9,11-14H2,(H,22,28)