2-[(E)-5-(2-chlorophenyl)-3-oxidanylidene-pent-4-enoyl]oxyethyl 4-nitrobenzoate

Systemtic Name: 2-[(E)-5-(2-chlorophenyl)-3-oxidanylidene-pent-4-enoyl]oxyethyl 4-nitrobenzoate Openeye Name: 2-[(E)-5-(2-chlorophenyl)-3-oxo-pent-4-enoyl]oxyethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-[(E)-5-(2-chlorophenyl)-1,3-dioxopent-4-enoxy]ethyl ester IUPAC Name: 2-[(E)-5-(2-chlorophenyl)-3-oxopent-4-enoyl]oxyethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-[(E)-5-(2-chlorophenyl)-3-keto-pent-4-enoyl]oxyethyl ester Formula: C20H16ClNO7 MolecularWeight: 417.79654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClNO7/c21-18-4-2-1-3-14(18)7-10-17(23)13-19(24)28-11-12-29-20(25)15-5-8-16(9-6-15)22(26)27/h1-10H,11-13H2/b10-7+