N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-1-[1-(3-phenylpropyl)piperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-1-[1-(3-phenylpropyl)piperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-2-amino-1-methyl-2-oxo-ethyl]-1-[1-(3-phenylpropyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-[(2S)-1-amino-1-oxopropan-2-yl]-1-[1-(3-phenylpropyl)-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-[(2S)-1-amino-1-oxopropan-2-yl]-1-[1-(3-phenylpropyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-2-amino-2-keto-1-methyl-ethyl]-1-[1-(3-phenylpropyl)-4-piperidyl]isonipecotamide Formula: C23H36N4O2 MolecularWeight: 400.55754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C1CCN(CC1)C2CCN(CC2)CCCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)C1CCN(CC1)C2CCN(CC2)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H36N4O2/c1-18(22(24)28)25-23(29)20-9-16-27(17-10-20)21-11-14-26(15-12-21)13-5-8-19-6-3-2-4-7-19/h2-4,6-7,18,20-21H,5,8-17H2,1H3,(H2,24,28)(H,25,29)/t18-/m0/s1