ethyl (Z)-2-(phenylcarbonyl)-3-(pyridin-3-ylamino)but-2-enoate

Systemtic Name: ethyl (Z)-2-(phenylcarbonyl)-3-(pyridin-3-ylamino)but-2-enoate Openeye Name: ethyl (Z)-2-benzoyl-3-(3-pyridylamino)but-2-enoate CAS Name: (Z)-2-benzoyl-3-(3-pyridinylamino)-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-benzoyl-3-(pyridin-3-ylamino)but-2-enoate Traditional Name: (Z)-2-benzoyl-3-(3-pyridylamino)but-2-enoic acid ethyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)NC1=CN=CC=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3/c1-3-23-18(22)16(17(21)14-8-5-4-6-9-14)13(2)20-15-10-7-11-19-12-15/h4-12,20H,3H2,1-2H3/b16-13-