3,5-dimethyl-N-[(2-methyl-3-nitro-phenyl)methyl]aniline

Systemtic Name: 3,5-dimethyl-N-[(2-methyl-3-nitro-phenyl)methyl]aniline Openeye Name: 3,5-dimethyl-N-[(2-methyl-3-nitro-phenyl)methyl]aniline CAS Name: 3,5-dimethyl-N-[(2-methyl-3-nitrophenyl)methyl]aniline IUPAC Name: 3,5-dimethyl-N-[(2-methyl-3-nitrophenyl)methyl]aniline Traditional Name: (3,5-dimethylphenyl)-(2-methyl-3-nitro-benzyl)amine Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NCC2=C(C(=CC=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NCC2=C(C(=CC=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C16H18N2O2/c1-11-7-12(2)9-15(8-11)17-10-14-5-4-6-16(13(14)3)18(19)20/h4-9,17H,10H2,1-3H3