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

Systemtic Name: [2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: [2-(N-isopropylanilino)-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-oxo-2-(N-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-propan-2-ylanilino)ethyl] (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyric acid [2-(N-isopropylanilino)-2-keto-ethyl] ester Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N(C1=CC=CC=C1)C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)N(C1=CC=CC=C1)C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C28H32N2O4/c1-19(2)27(29-25(31)17-22-13-10-12-21-11-8-9-16-24(21)22)28(33)34-18-26(32)30(20(3)4)23-14-6-5-7-15-23/h5-16,19-20,27H,17-18H2,1-4H3,(H,29,31)/t27-/m0/s1