4-[3,5-bis(chloranyl)-4-methyl-phenyl]imino-5-isocyano-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[3,5-bis(chloranyl)-4-methyl-phenyl]imino-5-isocyano-2-phenyl-pyrazol-3-one Openeye Name: 4-(3,5-dichloro-4-methyl-phenyl)imino-5-isocyano-2-phenyl-pyrazol-3-one CAS Name: 4-(3,5-dichloro-4-methylphenyl)imino-5-isocyano-2-phenyl-3-pyrazolone IUPAC Name: 4-(3,5-dichloro-4-methylphenyl)imino-5-isocyano-2-phenylpyrazol-3-one Traditional Name: 4-(3,5-dichloro-4-methyl-phenyl)imino-5-isocyano-2-phenyl-2-pyrazolin-3-one Formula: C17H10Cl2N4O MolecularWeight: 357.1935

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)N=C2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1Cl)N=C2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-])Cl

InChI

InChI=1S/C17H10Cl2N4O/c1-10-13(18)8-11(9-14(10)19)21-15-16(20-2)22-23(17(15)24)12-6-4-3-5-7-12/h3-9H,1H3