[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: [2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: [2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl] (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]butanoic acid [2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl] (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyric acid [2-keto-2-[(3S)-3-methylpiperidino]ethyl] ester Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)COC(=O)C(C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)COC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H32N2O4/c1-17(2)24(25(30)31-16-23(29)27-13-7-8-18(3)15-27)26-22(28)14-20-11-6-10-19-9-4-5-12-21(19)20/h4-6,9-12,17-18,24H,7-8,13-16H2,1-3H3,(H,26,28)/t18-,24-/m0/s1