(4-methyl-3-nitro-phenyl)methyl-(phenylmethyl)azanium

Systemtic Name: (4-methyl-3-nitro-phenyl)methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(4-methyl-3-nitro-phenyl)methyl]ammonium CAS Name: (4-methyl-3-nitrophenyl)methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(4-methyl-3-nitrophenyl)methyl]azanium Traditional Name: benzyl-(4-methyl-3-nitro-benzyl)ammonium Formula: C15H17N2O2+ MolecularWeight: 257.30768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH2+]CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH2+]CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O2/c1-12-7-8-14(9-15(12)17(18)19)11-16-10-13-5-3-2-4-6-13/h2-9,16H,10-11H2,1H3/p+1