methyl N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]carbamate

Systemtic Name: methyl N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]carbamate Openeye Name: methyl N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]carbamate CAS Name: N-[(E)-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]methylideneamino]carbamic acid methyl ester IUPAC Name: methyl N-[(E)-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]methylideneamino]carbamate Traditional Name: N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]carbamic acid methyl ester Formula: C18H15N5O4 MolecularWeight: 365.3428

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NN=CC1=CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)N/N=C/C1=CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H15N5O4/c1-27-18(24)20-19-11-14-12-22(15-5-3-2-4-6-15)21-17(14)13-7-9-16(10-8-13)23(25)26/h2-12H,1H3,(H,20,24)/b19-11+