N-methyl-2,4-dinitro-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]aniline

Systemtic Name: N-methyl-2,4-dinitro-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]aniline Openeye Name: N-methyl-2,4-dinitro-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]aniline CAS Name: N-methyl-2,4-dinitro-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]aniline IUPAC Name: N-methyl-2,4-dinitro-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]aniline Traditional Name: (2,4-dinitrophenyl)-methyl-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]amine Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC(=NN1)C2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CCCC1=CC(=NN1)C2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4/c1-22(18-10-9-16(23(25)26)13-19(18)24(27)28)11-5-8-15-12-17(21-20-15)14-6-3-2-4-7-14/h2-4,6-7,9-10,12-13H,5,8,11H2,1H3,(H,20,21)