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

Systemtic Name: (3S)-N-[2-(benzotriazol-1-yl)ethyl]-6-oxidanylidene-1-(3-phenylpropyl)piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(benzotriazol-1-yl)ethyl]-6-oxo-1-(3-phenylpropyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-(1-benzotriazolyl)ethyl]-6-oxo-1-(3-phenylpropyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(benzotriazol-1-yl)ethyl]-6-oxo-1-(3-phenylpropyl)piperidine-3-carboxamide Traditional Name: (3S)-N-[2-(benzotriazol-1-yl)ethyl]-6-keto-1-(3-phenylpropyl)nipecotamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCCN2C3=CC=CC=C3N=N2)CCCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCCN2C3=CC=CC=C3N=N2)CCCC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O2/c29-22-13-12-19(17-27(22)15-6-9-18-7-2-1-3-8-18)23(30)24-14-16-28-21-11-5-4-10-20(21)25-26-28/h1-5,7-8,10-11,19H,6,9,12-17H2,(H,24,30)/t19-/m0/s1