4-azanyl-4-oxidanylidene-2-[(2,3,4-trimethoxyphenyl)methylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(2,3,4-trimethoxyphenyl)methylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[(2,3,4-trimethoxyphenyl)methylamino]butanoic acid CAS Name: 4-amino-4-oxo-2-[(2,3,4-trimethoxyphenyl)methylamino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(2,3,4-trimethoxyphenyl)methylamino]butanoic acid Traditional Name: 4-amino-4-keto-2-[(2,3,4-trimethoxybenzyl)amino]butyric acid Formula: C14H20N2O6 MolecularWeight: 312.3184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNC(CC(=O)N)C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNC(CC(=O)N)C(=O)O)OC)OC

InChI

InChI=1S/C14H20N2O6/c1-20-10-5-4-8(12(21-2)13(10)22-3)7-16-9(14(18)19)6-11(15)17/h4-5,9,16H,6-7H2,1-3H3,(H2,15,17)(H,18,19)