3-(imidazol-1-ylmethyl)-N-[(4-nitrophenyl)methyl]aniline

Systemtic Name: 3-(imidazol-1-ylmethyl)-N-[(4-nitrophenyl)methyl]aniline Openeye Name: 3-(imidazol-1-ylmethyl)-N-[(4-nitrophenyl)methyl]aniline CAS Name: 3-(1-imidazolylmethyl)-N-[(4-nitrophenyl)methyl]aniline IUPAC Name: 3-(imidazol-1-ylmethyl)-N-[(4-nitrophenyl)methyl]aniline Traditional Name: [3-(imidazol-1-ylmethyl)phenyl]-(4-nitrobenzyl)amine Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])CN3C=CN=C3

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])CN3C=CN=C3

InChI

InChI=1S/C17H16N4O2/c22-21(23)17-6-4-14(5-7-17)11-19-16-3-1-2-15(10-16)12-20-9-8-18-13-20/h1-10,13,19H,11-12H2