2-(4-acetamidophenoxy)ethyl (E)-5-(2-nitrophenyl)-3-oxidanylidene-pent-4-enoate

Systemtic Name: 2-(4-acetamidophenoxy)ethyl (E)-5-(2-nitrophenyl)-3-oxidanylidene-pent-4-enoate Openeye Name: 2-(4-acetamidophenoxy)ethyl (E)-5-(2-nitrophenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(2-nitrophenyl)-3-oxo-4-pentenoic acid 2-(4-acetamidophenoxy)ethyl ester IUPAC Name: 2-(4-acetamidophenoxy)ethyl (E)-5-(2-nitrophenyl)-3-oxopent-4-enoate Traditional Name: (E)-3-keto-5-(2-nitrophenyl)pent-4-enoic acid 2-(4-acetamidophenoxy)ethyl ester Formula: C21H20N2O7 MolecularWeight: 412.3927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OCCOC(=O)CC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OCCOC(=O)CC(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O7/c1-15(24)22-17-7-10-19(11-8-17)29-12-13-30-21(26)14-18(25)9-6-16-4-2-3-5-20(16)23(27)28/h2-11H,12-14H2,1H3,(H,22,24)/b9-6+