[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-cyano-3-phenyl-prop-2-enoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-cyano-3-phenyl-prop-2-enoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 2-cyano-3-phenyl-prop-2-enoate CAS Name: 2-cyano-3-phenyl-2-propenoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 2-cyano-3-phenylprop-2-enoate Traditional Name: 2-cyano-3-phenyl-acrylic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CC=C2)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CC=C2)C#N

InChI

InChI=1S/C22H22N2O3/c1-2-3-7-17-10-12-20(13-11-17)24-21(25)16-27-22(26)19(15-23)14-18-8-5-4-6-9-18/h4-6,8-14H,2-3,7,16H2,1H3,(H,24,25)