butyl 4-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: butyl 4-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]benzoate Openeye Name: butyl 4-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[2-cyano-3-[4-(diethylamino)phenyl]-1-oxoprop-2-enyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[2-cyano-3-[4-(diethylamino)phenyl]acryloyl]amino]benzoic acid butyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O3/c1-4-7-16-31-25(30)20-10-12-22(13-11-20)27-24(29)21(18-26)17-19-8-14-23(15-9-19)28(5-2)6-3/h8-15,17H,4-7,16H2,1-3H3,(H,27,29)