2-[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]ethyl N-phenylcarbamate

Systemtic Name: 2-[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]ethyl N-phenylcarbamate Openeye Name: 2-[4-(2-chloro-4-nitro-phenyl)azo-3-methyl-5-oxo-4H-pyrazol-1-yl]ethyl N-phenylcarbamate CAS Name: N-phenylcarbamic acid 2-[4-(2-chloro-4-nitrophenyl)azo-3-methyl-5-oxo-4H-pyrazol-1-yl]ethyl ester IUPAC Name: 2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]ethyl N-phenylcarbamate Traditional Name: N-phenylcarbamic acid 2-[4-(2-chloro-4-nitro-phenyl)azo-5-keto-3-methyl-2-pyrazolin-1-yl]ethyl ester Formula: C19H17ClN6O5 MolecularWeight: 444.82848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)CCOC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)CCOC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H17ClN6O5/c1-12-17(23-22-16-8-7-14(26(29)30)11-15(16)20)18(27)25(24-12)9-10-31-19(28)21-13-5-3-2-4-6-13/h2-8,11,17H,9-10H2,1H3,(H,21,28)