N-[(1-tert-butylpyrazol-4-yl)methyl]-3-nitro-aniline

Systemtic Name: N-[(1-tert-butylpyrazol-4-yl)methyl]-3-nitro-aniline Openeye Name: N-[(1-tert-butylpyrazol-4-yl)methyl]-3-nitro-aniline CAS Name: N-[(1-tert-butyl-4-pyrazolyl)methyl]-3-nitroaniline IUPAC Name: N-[(1-tert-butylpyrazol-4-yl)methyl]-3-nitroaniline Traditional Name: (1-tert-butylpyrazol-4-yl)methyl-(3-nitrophenyl)amine Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=N1)CNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1C=C(C=N1)CNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O2/c1-14(2,3)17-10-11(9-16-17)8-15-12-5-4-6-13(7-12)18(19)20/h4-7,9-10,15H,8H2,1-3H3