5-[4-[(E)-N-[(4-methoxyphenyl)carbonylamino]-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid

Systemtic Name: 5-[4-[(E)-N-[(4-methoxyphenyl)carbonylamino]-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid Openeye Name: 5-[4-[(E)-N-[(4-methoxybenzoyl)amino]-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid CAS Name: 5-[4-[(1E)-1-[[(4-methoxyphenyl)-oxomethyl]hydrazinylidene]ethyl]phenyl]-2-furancarboxylic acid IUPAC Name: 5-[4-[(E)-N-[(4-methoxybenzoyl)amino]-C-methylcarbonimidoyl]phenyl]furan-2-carboxylic acid Traditional Name: 5-[4-[(E)-C-methyl-N-(p-anisoylamino)carbonimidoyl]phenyl]-2-furoic acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)OC)C2=CC=C(C=C2)C3=CC=C(O3)C(=O)O

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)C3=CC=C(O3)C(=O)O

InChI

InChI=1S/C21H18N2O5/c1-13(22-23-20(24)16-7-9-17(27-2)10-8-16)14-3-5-15(6-4-14)18-11-12-19(28-18)21(25)26/h3-12H,1-2H3,(H,23,24)(H,25,26)/b22-13+