N-[1-(3-azanylpropylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: N-[1-(3-azanylpropylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-[2-(3-aminopropylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]-1-benzyl-piperidine-3-carboxamide CAS Name: N-[1-(3-aminopropylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]-1-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-[1-(3-aminopropylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]-1-benzylpiperidine-3-carboxamide Traditional Name: N-[2-(3-aminopropylamino)-2-keto-1-(2-naphthylmethyl)ethyl]-1-benzyl-nipecotamide Formula: C29H36N4O2 MolecularWeight: 472.62174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2)C(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCCCN

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2)C(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCCCN

InChI

InChI=1S/C29H36N4O2/c30-15-7-16-31-29(35)27(19-23-13-14-24-10-4-5-11-25(24)18-23)32-28(34)26-12-6-17-33(21-26)20-22-8-2-1-3-9-22/h1-5,8-11,13-14,18,26-27H,6-7,12,15-17,19-21,30H2,(H,31,35)(H,32,34)