[4-[2-cyano-3-[(4-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] naphthalene-1-carboxylate

Systemtic Name: [4-[2-cyano-3-[(4-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] naphthalene-1-carboxylate Openeye Name: [4-[2-cyano-3-(4-fluoroanilino)-3-oxo-prop-1-enyl]-2-ethoxy-phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [4-[2-cyano-3-(4-fluoroanilino)-3-oxoprop-1-enyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-(4-fluoroanilino)-3-oxoprop-1-enyl]-2-ethoxyphenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [4-[2-cyano-3-(4-fluoroanilino)-3-keto-prop-1-enyl]-2-ethoxy-phenyl] ester Formula: C29H21FN2O4 MolecularWeight: 480.486443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)F)OC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)F)OC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H21FN2O4/c1-2-35-27-17-19(16-21(18-31)28(33)32-23-13-11-22(30)12-14-23)10-15-26(27)36-29(34)25-9-5-7-20-6-3-4-8-24(20)25/h3-17H,2H2,1H3,(H,32,33)