methyl (3S)-3-azanyl-4-oxidanylidene-4-(phenethylamino)butanoate

Systemtic Name: methyl (3S)-3-azanyl-4-oxidanylidene-4-(phenethylamino)butanoate Openeye Name: methyl (3S)-3-amino-4-oxo-4-(phenethylamino)butanoate CAS Name: (3S)-3-amino-4-oxo-4-(phenethylamino)butanoic acid methyl ester IUPAC Name: methyl (3S)-3-amino-4-oxo-4-(phenethylamino)butanoate Traditional Name: (3S)-3-amino-4-keto-4-(phenethylamino)butyric acid methyl ester Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)NCCC1=CC=CC=C1)N

Isomeric SMILES

COC(=O)C[C@@H](C(=O)NCCC1=CC=CC=C1)N

InChI

InChI=1S/C13H18N2O3/c1-18-12(16)9-11(14)13(17)15-8-7-10-5-3-2-4-6-10/h2-6,11H,7-9,14H2,1H3,(H,15,17)/t11-/m0/s1