2-(4-chlorophenyl)carbonyl-5-methyl-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)carbonyl-5-methyl-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one Openeye Name: 2-(4-chlorobenzoyl)-5-methyl-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-5-methyl-4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1H-pyrazol-3-one IUPAC Name: 2-(4-chlorobenzoyl)-5-methyl-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one Traditional Name: 2-(4-chlorobenzoyl)-4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-pyrazolin-3-one Formula: C18H13ClN2O3 MolecularWeight: 340.76042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C(=O)C2=CC=C(C=C2)Cl)C=C3C=CC(=O)C=C3

Isomeric SMILES

CC1=C(C(=O)N(N1)C(=O)C2=CC=C(C=C2)Cl)C=C3C=CC(=O)C=C3

InChI

InChI=1S/C18H13ClN2O3/c1-11-16(10-12-2-8-15(22)9-3-12)18(24)21(20-11)17(23)13-4-6-14(19)7-5-13/h2-10,20H,1H3