(2S)-2-[[2-(ethoxycarbonylcarbamoyl)phenyl]carbonylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: (2S)-2-[[2-(ethoxycarbonylcarbamoyl)phenyl]carbonylamino]-3,3-dimethyl-butanoic acid Openeye Name: (2S)-2-[[2-(ethoxycarbonylcarbamoyl)benzoyl]amino]-3,3-dimethyl-butanoic acid CAS Name: (2S)-2-[[[2-[(ethoxycarbonylamino)-oxomethyl]phenyl]-oxomethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: (2S)-2-[[2-(ethoxycarbonylcarbamoyl)benzoyl]amino]-3,3-dimethylbutanoic acid Traditional Name: (2S)-2-[[2-(carbethoxycarbamoyl)benzoyl]amino]-3,3-dimethyl-butyric acid Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C1=CC=CC=C1C(=O)NC(C(=O)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)NC(=O)C1=CC=CC=C1C(=O)N[C@H](C(=O)O)C(C)(C)C

InChI

InChI=1S/C17H22N2O6/c1-5-25-16(24)19-14(21)11-9-7-6-8-10(11)13(20)18-12(15(22)23)17(2,3)4/h6-9,12H,5H2,1-4H3,(H,18,20)(H,22,23)(H,19,21,24)/t12-/m1/s1