4-[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoic acid

Systemtic Name: 4-[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoic acid Openeye Name: 4-[2-[2-cyanoethyl(methyl)amino]-2-oxo-ethoxy]-3-methoxy-benzoic acid CAS Name: 4-[2-[2-cyanoethyl(methyl)amino]-2-oxoethoxy]-3-methoxybenzoic acid IUPAC Name: 4-[2-[2-cyanoethyl(methyl)amino]-2-oxoethoxy]-3-methoxybenzoic acid Traditional Name: 4-[2-[2-cyanoethyl(methyl)amino]-2-keto-ethoxy]-3-methoxy-benzoic acid Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC1=C(C=C(C=C1)C(=O)O)OC

Isomeric SMILES

CN(CCC#N)C(=O)COC1=C(C=C(C=C1)C(=O)O)OC

InChI

InChI=1S/C14H16N2O5/c1-16(7-3-6-15)13(17)9-21-11-5-4-10(14(18)19)8-12(11)20-2/h4-5,8H,3,7,9H2,1-2H3,(H,18,19)