3-[[1-(2-azanyl-3-methyl-butanoyl)-3-phenyl-azetidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[1-(2-azanyl-3-methyl-butanoyl)-3-phenyl-azetidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[1-(2-amino-3-methyl-butanoyl)-3-phenyl-azetidine-2-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[[1-(2-amino-3-methyl-1-oxobutyl)-3-phenyl-2-azetidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[1-(2-amino-3-methylbutanoyl)-3-phenylazetidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[1-(2-amino-3-methyl-butanoyl)-3-phenyl-azetidine-2-carbonyl]amino]-4-keto-butyric acid Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC(C1C(=O)NC(CC(=O)O)C=O)C2=CC=CC=C2)N

Isomeric SMILES

CC(C)C(C(=O)N1CC(C1C(=O)NC(CC(=O)O)C=O)C2=CC=CC=C2)N

InChI

InChI=1S/C19H25N3O5/c1-11(2)16(20)19(27)22-9-14(12-6-4-3-5-7-12)17(22)18(26)21-13(10-23)8-15(24)25/h3-7,10-11,13-14,16-17H,8-9,20H2,1-2H3,(H,21,26)(H,24,25)