ethyl 1-[3-[[4-(methylamino)-3-nitro-phenyl]carbonylamino]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[3-[[4-(methylamino)-3-nitro-phenyl]carbonylamino]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[3-[[4-(methylamino)-3-nitro-benzoyl]amino]phenyl]pyrazole-3-carboxylate CAS Name: 1-[3-[[[4-(methylamino)-3-nitrophenyl]-oxomethyl]amino]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[4-(methylamino)-3-nitrobenzoyl]amino]phenyl]pyrazole-3-carboxylate Traditional Name: 1-[3-[[4-(methylamino)-3-nitro-benzoyl]amino]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C20H19N5O5 MolecularWeight: 409.39536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O5/c1-3-30-20(27)17-9-10-24(23-17)15-6-4-5-14(12-15)22-19(26)13-7-8-16(21-2)18(11-13)25(28)29/h4-12,21H,3H2,1-2H3,(H,22,26)