3-[5-[2-cyano-3-(dimethylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]-2-methyl-benzoic acid

Systemtic Name: 3-[5-[2-cyano-3-(dimethylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]-2-methyl-benzoic acid Openeye Name: 3-[5-[2-cyano-3-(dimethylamino)-3-oxo-prop-1-enyl]-2-furyl]-2-methyl-benzoic acid CAS Name: 3-[5-[2-cyano-3-(dimethylamino)-3-oxoprop-1-enyl]-2-furanyl]-2-methylbenzoic acid IUPAC Name: 3-[5-[2-cyano-3-(dimethylamino)-3-oxoprop-1-enyl]furan-2-yl]-2-methylbenzoic acid Traditional Name: 3-[5-[2-cyano-3-(dimethylamino)-3-keto-prop-1-enyl]-2-furyl]-2-methyl-benzoic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1C(=O)O)C2=CC=C(O2)C=C(C#N)C(=O)N(C)C

Isomeric SMILES

CC1=C(C=CC=C1C(=O)O)C2=CC=C(O2)C=C(C#N)C(=O)N(C)C

InChI

InChI=1S/C18H16N2O4/c1-11-14(5-4-6-15(11)18(22)23)16-8-7-13(24-16)9-12(10-19)17(21)20(2)3/h4-9H,1-3H3,(H,22,23)