methyl (2S)-2-[[3-(2,2-dimethyl-3-oxidanyl-4-oxidanylidene-1-propan-2-yl-azetidin-3-yl)phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[3-(2,2-dimethyl-3-oxidanyl-4-oxidanylidene-1-propan-2-yl-azetidin-3-yl)phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[3-(3-hydroxy-1-isopropyl-2,2-dimethyl-4-oxo-azetidin-3-yl)benzoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[3-(3-hydroxy-2,2-dimethyl-4-oxo-1-propan-2-yl-3-azetidinyl)phenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(3-hydroxy-2,2-dimethyl-4-oxo-1-propan-2-ylazetidin-3-yl)benzoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[3-(3-hydroxy-1-isopropyl-4-keto-2,2-dimethyl-azetidin-3-yl)benzoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(C1(C)C)(C2=CC=CC(=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC)O

Isomeric SMILES

CC(C)N1C(=O)C(C1(C)C)(C2=CC=CC(=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC)O

InChI

InChI=1S/C25H30N2O5/c1-16(2)27-23(30)25(31,24(27,3)4)19-13-9-12-18(15-19)21(28)26-20(22(29)32-5)14-17-10-7-6-8-11-17/h6-13,15-16,20,31H,14H2,1-5H3,(H,26,28)/t20-,25?/m0/s1