3-azaniumyl-4-[(2-methyl-1-oxidanylidene-1-phenylmethoxy-propan-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 3-azaniumyl-4-[(2-methyl-1-oxidanylidene-1-phenylmethoxy-propan-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 3-azaniumyl-4-[(2-benzyloxy-1,1-dimethyl-2-oxo-ethyl)amino]-4-oxo-butanoate CAS Name: 3-ammonio-4-[(2-methyl-1-oxo-1-phenylmethoxypropan-2-yl)amino]-4-oxobutanoate IUPAC Name: 3-azaniumyl-4-[(2-methyl-1-oxo-1-phenylmethoxypropan-2-yl)amino]-4-oxobutanoate Traditional Name: 3-ammonio-4-[(2-benzoxy-2-keto-1,1-dimethyl-ethyl)amino]-4-keto-butyrate Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCC1=CC=CC=C1)NC(=O)C(CC(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)(C(=O)OCC1=CC=CC=C1)NC(=O)C(CC(=O)[O-])[NH3+]

InChI

InChI=1S/C15H20N2O5/c1-15(2,17-13(20)11(16)8-12(18)19)14(21)22-9-10-6-4-3-5-7-10/h3-7,11H,8-9,16H2,1-2H3,(H,17,20)(H,18,19)