4-[5-[(E)-[(2-methoxy-4-methyl-phenyl)carbonylhydrazinylidene]methyl]furan-2-yl]benzoic acid

Systemtic Name: 4-[5-[(E)-[(2-methoxy-4-methyl-phenyl)carbonylhydrazinylidene]methyl]furan-2-yl]benzoic acid Openeye Name: 4-[5-[(E)-[(2-methoxy-4-methyl-benzoyl)hydrazono]methyl]-2-furyl]benzoic acid CAS Name: 4-[5-[(E)-[[(2-methoxy-4-methylphenyl)-oxomethyl]hydrazinylidene]methyl]-2-furanyl]benzoic acid IUPAC Name: 4-[5-[(E)-[(2-methoxy-4-methylbenzoyl)hydrazinylidene]methyl]furan-2-yl]benzoic acid Traditional Name: 4-[5-[(E)-[(2-methoxy-4-methyl-benzoyl)hydrazono]methyl]-2-furyl]benzoic acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NN=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N/N=C/C2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)OC

InChI

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