methyl (2S)-2-[[[(3S)-3-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-2-oxidanylidene-azetidin-1-yl]-methyl-carbamoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[[(3S)-3-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-2-oxidanylidene-azetidin-1-yl]-methyl-carbamoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[[(3S)-3-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-2-oxo-azetidin-1-yl]-methyl-carbamoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[[(3S)-3-[[(2S)-2-acetamido-1-oxo-3-phenylpropyl]amino]-2-oxo-1-azetidinyl]-methylamino]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[[(3S)-3-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]-2-oxoazetidin-1-yl]-methylcarbamoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[[(3S)-3-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-2-keto-azetidin-1-yl]-methyl-carbamoyl]amino]-4-methyl-valeric acid methyl ester Formula: C23H33N5O6 MolecularWeight: 475.53802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)N(C)N1CC(C1=O)NC(=O)C(CC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)N(C)N1C[C@@H](C1=O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C23H33N5O6/c1-14(2)11-18(22(32)34-5)26-23(33)27(4)28-13-19(21(28)31)25-20(30)17(24-15(3)29)12-16-9-7-6-8-10-16/h6-10,14,17-19H,11-13H2,1-5H3,(H,24,29)(H,25,30)(H,26,33)/t17-,18-,19-/m0/s1