ethyl (Z)-3-methyl-4-oxidanylidene-4-[4-(phenylmethoxycarbonylamino)phenyl]but-2-enoate

Systemtic Name: ethyl (Z)-3-methyl-4-oxidanylidene-4-[4-(phenylmethoxycarbonylamino)phenyl]but-2-enoate Openeye Name: ethyl (Z)-4-[4-(benzyloxycarbonylamino)phenyl]-3-methyl-4-oxo-but-2-enoate CAS Name: (Z)-3-methyl-4-oxo-4-[4-(phenylmethoxycarbonylamino)phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-methyl-4-oxo-4-[4-(phenylmethoxycarbonylamino)phenyl]but-2-enoate Traditional Name: (Z)-4-[4-(benzyloxycarbonylamino)phenyl]-4-keto-3-methyl-but-2-enoic acid ethyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C(=O)C1=CC=C(C=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C(/C)\C(=O)C1=CC=C(C=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H21NO5/c1-3-26-19(23)13-15(2)20(24)17-9-11-18(12-10-17)22-21(25)27-14-16-7-5-4-6-8-16/h4-13H,3,14H2,1-2H3,(H,22,25)/b15-13-