N-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-aniline

Systemtic Name: N-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-aniline Openeye Name: N-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-aniline CAS Name: N-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl]-3-nitroaniline IUPAC Name: N-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl]-3-nitroaniline Traditional Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-(3-nitrophenyl)amine Formula: C17H15ClN4O2 MolecularWeight: 342.7796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CNC2=CC(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1CNC2=CC(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H15ClN4O2/c1-12-16(11-19-13-6-5-9-15(10-13)22(23)24)17(18)21(20-12)14-7-3-2-4-8-14/h2-10,19H,11H2,1H3