methyl (2S)-3-methyl-2-[4-(2-oxidanylidene-4-phenyl-azetidin-1-yl)butanoylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[4-(2-oxidanylidene-4-phenyl-azetidin-1-yl)butanoylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[4-(2-oxo-4-phenyl-azetidin-1-yl)butanoylamino]butanoate CAS Name: (2S)-3-methyl-2-[[1-oxo-4-(2-oxo-4-phenyl-1-azetidinyl)butyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[4-(2-oxo-4-phenylazetidin-1-yl)butanoylamino]butanoate Traditional Name: (2S)-2-[4-(2-keto-4-phenyl-azetidin-1-yl)butanoylamino]-3-methyl-butyric acid methyl ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CCCN1C(CC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)CCCN1C(CC1=O)C2=CC=CC=C2

InChI

InChI=1S/C19H26N2O4/c1-13(2)18(19(24)25-3)20-16(22)10-7-11-21-15(12-17(21)23)14-8-5-4-6-9-14/h4-6,8-9,13,15,18H,7,10-12H2,1-3H3,(H,20,22)/t15?,18-/m0/s1