ethyl (E)-3-diphenylphosphoryl-4-[(4-methylphenyl)amino]pent-3-enoate

Systemtic Name: ethyl (E)-3-diphenylphosphoryl-4-[(4-methylphenyl)amino]pent-3-enoate Openeye Name: ethyl (E)-3-diphenylphosphoryl-4-(4-methylanilino)pent-3-enoate CAS Name: (E)-3-diphenylphosphoryl-4-(4-methylanilino)-3-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-3-diphenylphosphoryl-4-(4-methylanilino)pent-3-enoate Traditional Name: (E)-3-diphenylphosphoryl-4-(p-toluidino)pent-3-enoic acid ethyl ester Formula: C26H28NO3P MolecularWeight: 433.479181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C(C)NC1=CC=C(C=C1)C)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C/C(=C(/C)\NC1=CC=C(C=C1)C)/P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H28NO3P/c1-4-30-26(28)19-25(21(3)27-22-17-15-20(2)16-18-22)31(29,23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-18,27H,4,19H2,1-3H3/b25-21+