4-azanyl-4-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[(3,4,5-trimethoxybenzoyl)amino]butanoic acid CAS Name: 4-amino-4-oxo-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(3,4,5-trimethoxybenzoyl)amino]butanoic acid Traditional Name: 4-amino-4-keto-2-[(3,4,5-trimethoxybenzoyl)amino]butyric acid Formula: C14H18N2O7 MolecularWeight: 326.30192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C14H18N2O7/c1-21-9-4-7(5-10(22-2)12(9)23-3)13(18)16-8(14(19)20)6-11(15)17/h4-5,8H,6H2,1-3H3,(H2,15,17)(H,16,18)(H,19,20)