methyl 2-[(3R,4S)-3-[(1S)-1-[[(2S)-2-azanylpropanoyl]amino]-3-methyl-butyl]-2-oxidanylidene-4-phenyl-azetidin-1-yl]ethanoate

Systemtic Name: methyl 2-[(3R,4S)-3-[(1S)-1-[[(2S)-2-azanylpropanoyl]amino]-3-methyl-butyl]-2-oxidanylidene-4-phenyl-azetidin-1-yl]ethanoate Openeye Name: methyl 2-[(3R,4S)-3-[(1S)-1-[[(2S)-2-aminopropanoyl]amino]-3-methyl-butyl]-2-oxo-4-phenyl-azetidin-1-yl]acetate CAS Name: 2-[(3R,4S)-3-[(1S)-1-[[(2S)-2-amino-1-oxopropyl]amino]-3-methylbutyl]-2-oxo-4-phenyl-1-azetidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3R,4S)-3-[(1S)-1-[[(2S)-2-aminopropanoyl]amino]-3-methylbutyl]-2-oxo-4-phenylazetidin-1-yl]acetate Traditional Name: 2-[(3R,4S)-3-[(1S)-1-[[(2S)-2-aminopropanoyl]amino]-3-methyl-butyl]-2-keto-4-phenyl-azetidin-1-yl]acetic acid methyl ester Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1C(N(C1=O)CC(=O)OC)C2=CC=CC=C2)NC(=O)C(C)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC(C)C)[C@@H]1[C@H](N(C1=O)CC(=O)OC)C2=CC=CC=C2)N

InChI

InChI=1S/C20H29N3O4/c1-12(2)10-15(22-19(25)13(3)21)17-18(14-8-6-5-7-9-14)23(20(17)26)11-16(24)27-4/h5-9,12-13,15,17-18H,10-11,21H2,1-4H3,(H,22,25)/t13-,15-,17+,18+/m0/s1