1-[(2S)-1-[ethyl(naphthalen-1-yl)amino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-1-[ethyl(naphthalen-1-yl)amino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-[ethyl(1-naphthyl)amino]-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-1-[ethyl(1-naphthalenyl)amino]-1-oxopropan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-[ethyl(naphthalen-1-yl)amino]-1-oxopropan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-[ethyl(1-naphthyl)amino]-2-keto-1-methyl-ethyl]piperidin-1-ium-4-carboxamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)C(C)[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)[C@H](C)[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H27N3O2/c1-3-24(19-10-6-8-16-7-4-5-9-18(16)19)21(26)15(2)23-13-11-17(12-14-23)20(22)25/h4-10,15,17H,3,11-14H2,1-2H3,(H2,22,25)/p+1/t15-/m0/s1