3-chloranylpropyl (E)-3-(3-nitrophenyl)-4-oxidanylidene-pent-2-enoate

Systemtic Name: 3-chloranylpropyl (E)-3-(3-nitrophenyl)-4-oxidanylidene-pent-2-enoate Openeye Name: 3-chloropropyl (E)-3-(3-nitrophenyl)-4-oxo-pent-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-4-oxo-2-pentenoic acid 3-chloropropyl ester IUPAC Name: 3-chloropropyl (E)-3-(3-nitrophenyl)-4-oxopent-2-enoate Traditional Name: (E)-4-keto-3-(3-nitrophenyl)pent-2-enoic acid 3-chloropropyl ester Formula: C14H14ClNO5 MolecularWeight: 311.71766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC(=O)OCCCCl)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)/C(=C/C(=O)OCCCCl)/C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClNO5/c1-10(17)13(9-14(18)21-7-3-6-15)11-4-2-5-12(8-11)16(19)20/h2,4-5,8-9H,3,6-7H2,1H3/b13-9-