[4-[(E)-3-(butylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]phenyl] 2,2-diphenylethanoate

Systemtic Name: [4-[(E)-3-(butylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]phenyl] 2,2-diphenylethanoate Openeye Name: [4-[(E)-3-(butylamino)-2-cyano-3-oxo-prop-1-enyl]phenyl] 2,2-diphenylacetate CAS Name: 2,2-diphenylacetic acid [4-[(E)-3-(butylamino)-2-cyano-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(butylamino)-2-cyano-3-oxoprop-1-enyl]phenyl] 2,2-diphenylacetate Traditional Name: 2,2-diphenylacetic acid [4-[(E)-3-(butylamino)-2-cyano-3-keto-prop-1-enyl]phenyl] ester Formula: C28H26N2O3 MolecularWeight: 438.51764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC=C(C=C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=CC=C(C=C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C28H26N2O3/c1-2-3-18-30-27(31)24(20-29)19-21-14-16-25(17-15-21)33-28(32)26(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,19,26H,2-3,18H2,1H3,(H,30,31)/b24-19+