benzene; (E)-7-chloranyl-1-(4-nitrophenyl)hept-1-en-3-one

Systemtic Name: benzene; (E)-7-chloranyl-1-(4-nitrophenyl)hept-1-en-3-one Openeye Name: benzene; (E)-7-chloro-1-(4-nitrophenyl)hept-1-en-3-one CAS Name: benzene; (E)-7-chloro-1-(4-nitrophenyl)-1-hepten-3-one IUPAC Name: benzene; (E)-7-chloro-1-(4-nitrophenyl)hept-1-en-3-one Traditional Name: benzene; (E)-7-chloro-1-(4-nitrophenyl)hept-1-en-3-one Formula: C19H20ClNO3 MolecularWeight: 345.82

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CC=C1.C1=CC(=CC=C1C=CC(=O)CCCCCl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClNO3.C6H6/c14-10-2-1-3-13(16)9-6-11-4-7-12(8-5-11)15(17)18;1-2-4-6-5-3-1/h4-9H,1-3,10H2;1-6H/b9-6+;