2-[[6-[(2-ethoxy-2-oxidanylidene-ethanoyl)-methyl-amino]-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[6-[(2-ethoxy-2-oxidanylidene-ethanoyl)-methyl-amino]-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[6-[(2-ethoxy-2-oxo-acetyl)-methyl-amino]-7-oxo-cyclohepta-1,3,5-trien-1-yl]amino]-2-oxo-acetic acid CAS Name: 2-[[6-[(2-ethoxy-1,2-dioxoethyl)-methylamino]-7-oxo-1-cyclohepta-1,3,5-trienyl]amino]-2-oxoacetic acid IUPAC Name: 2-[[6-[(2-ethoxy-2-oxoacetyl)-methylamino]-7-oxocyclohepta-1,3,5-trien-1-yl]amino]-2-oxoacetic acid Traditional Name: 2-[[6-[ethoxalyl(methyl)amino]-7-keto-cyclohepta-1,3,5-trien-1-yl]amino]-2-keto-acetic acid Formula: C14H14N2O7 MolecularWeight: 322.27016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)N(C)C1=CC=CC=C(C1=O)NC(=O)C(=O)O

Isomeric SMILES

CCOC(=O)C(=O)N(C)C1=CC=CC=C(C1=O)NC(=O)C(=O)O

InChI

InChI=1S/C14H14N2O7/c1-3-23-14(22)12(19)16(2)9-7-5-4-6-8(10(9)17)15-11(18)13(20)21/h4-7H,3H2,1-2H3,(H,20,21)(H,15,17,18)