[(Z)-[1-azanyl-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethylidene]amino] 3-chloranylbenzoate

Systemtic Name: [(Z)-[1-azanyl-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethylidene]amino] 3-chloranylbenzoate Openeye Name: [(Z)-[1-amino-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethylidene]amino] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [(Z)-[1-amino-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethylidene]amino] ester IUPAC Name: [(Z)-[1-amino-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethylidene]amino] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [(Z)-[1-amino-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethylidene]amino] ester Formula: C14H14ClN5O4 MolecularWeight: 351.74506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=NOC(=O)C2=CC(=CC=C2)Cl)N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C/C(=N/OC(=O)C2=CC(=CC=C2)Cl)/N)C)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClN5O4/c1-8-13(20(22)23)9(2)19(17-8)7-12(16)18-24-14(21)10-4-3-5-11(15)6-10/h3-6H,7H2,1-2H3,(H2,16,18)