[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-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-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-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-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N(C)CCC#N)NC(=O)CC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)N(C)CCC#N)NC(=O)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C23H27N3O4/c1-16(2)22(23(29)30-15-21(28)26(3)13-7-12-24)25-20(27)14-18-10-6-9-17-8-4-5-11-19(17)18/h4-6,8-11,16,22H,7,13-15H2,1-3H3,(H,25,27)/t22-/m0/s1