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

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

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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)22-17-6-9-20(10-7-17)29-11-12-30-21(26)14-19(25)8-5-16-3-2-4-18(13-16)23(27)28/h2-10,13H,11-12,14H2,1H3,(H,22,24)/b8-5+