1-[4,5-bis(chloranyl)-1-(4-nitrophenyl)carbonyl-cyclohexa-2,4-dien-1-yl]propan-2-one

Systemtic Name: 1-[4,5-bis(chloranyl)-1-(4-nitrophenyl)carbonyl-cyclohexa-2,4-dien-1-yl]propan-2-one Openeye Name: 1-[4,5-dichloro-1-(4-nitrobenzoyl)cyclohexa-2,4-dien-1-yl]propan-2-one CAS Name: 1-[4,5-dichloro-1-[(4-nitrophenyl)-oxomethyl]-1-cyclohexa-2,4-dienyl]-2-propanone IUPAC Name: 1-[4,5-dichloro-1-(4-nitrobenzoyl)cyclohexa-2,4-dien-1-yl]propan-2-one Traditional Name: 1-[4,5-dichloro-1-(4-nitrobenzoyl)cyclohexa-2,4-dien-1-yl]acetone Formula: C16H13Cl2NO4 MolecularWeight: 354.18472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1(CC(=C(C=C1)Cl)Cl)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CC1(CC(=C(C=C1)Cl)Cl)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13Cl2NO4/c1-10(20)8-16(7-6-13(17)14(18)9-16)15(21)11-2-4-12(5-3-11)19(22)23/h2-7H,8-9H2,1H3