4-[azanyl-(phenylmethyl)amino]-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[azanyl-(phenylmethyl)amino]-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[amino(benzyl)amino]-3-hydroxy-4-oxo-butanoic acid CAS Name: 4-[amino-(phenylmethyl)amino]-3-hydroxy-4-oxobutanoic acid IUPAC Name: 4-[amino(benzyl)amino]-3-hydroxy-4-oxobutanoic acid Traditional Name: 4-[amino(benzyl)amino]-3-hydroxy-4-keto-butyric acid Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C(=O)C(CC(=O)O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CN(C(=O)C(CC(=O)O)O)N

InChI

InChI=1S/C11H14N2O4/c12-13(7-8-4-2-1-3-5-8)11(17)9(14)6-10(15)16/h1-5,9,14H,6-7,12H2,(H,15,16)