2-azanylbutanedioic acid; methyl 2-azanyl-3-phenyl-propanoate

Systemtic Name: 2-azanylbutanedioic acid; methyl 2-azanyl-3-phenyl-propanoate Openeye Name: 2-aminobutanedioic acid; methyl 2-amino-3-phenyl-propanoate CAS Name: 2-aminobutanedioic acid; 2-amino-3-phenylpropanoic acid methyl ester IUPAC Name: 2-aminobutanedioic acid; methyl 2-amino-3-phenylpropanoate Traditional Name: 2-amino-3-phenyl-propionic acid methyl ester; 2-aminosuccinic acid Formula: C14H20N2O6 MolecularWeight: 312.3184

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)N.C(C(C(=O)O)N)C(=O)O

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)N.C(C(C(=O)O)N)C(=O)O

InChI

InChI=1S/C10H13NO2.C4H7NO4/c1-13-10(12)9(11)7-8-5-3-2-4-6-8;5-2(4(8)9)1-3(6)7/h2-6,9H,7,11H2,1H3;2H,1,5H2,(H,6,7)(H,8,9)