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

Systemtic Name: 3-azaniumyl-4-[(1-azanyl-1-oxidanylidene-propan-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(2-amino-1-methyl-2-oxo-ethyl)amino]-3-azaniumyl-4-oxo-butanoate CAS Name: 4-[(1-amino-1-oxopropan-2-yl)amino]-3-ammonio-4-oxobutanoate IUPAC Name: 4-[(1-amino-1-oxopropan-2-yl)amino]-3-azaniumyl-4-oxobutanoate Traditional Name: 4-[(2-amino-2-keto-1-methyl-ethyl)amino]-3-ammonio-4-keto-butyrate Formula: C7H13N3O4 MolecularWeight: 203.19582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13N3O4/c1-3(6(9)13)10-7(14)4(8)2-5(11)12/h3-4H,2,8H2,1H3,(H2,9,13)(H,10,14)(H,11,12)