(3,5-dimethylphenyl)-(2-ethyl-5-nitro-phenyl)methanamine

Systemtic Name: (3,5-dimethylphenyl)-(2-ethyl-5-nitro-phenyl)methanamine Openeye Name: (3,5-dimethylphenyl)-(2-ethyl-5-nitro-phenyl)methanamine CAS Name: (3,5-dimethylphenyl)-(2-ethyl-5-nitrophenyl)methanamine IUPAC Name: (3,5-dimethylphenyl)-(2-ethyl-5-nitrophenyl)methanamine Traditional Name: [(3,5-dimethylphenyl)-(2-ethyl-5-nitro-phenyl)methyl]amine Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CC(=C2)C)C)N

Isomeric SMILES

CCC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CC(=C2)C)C)N

InChI

InChI=1S/C17H20N2O2/c1-4-13-5-6-15(19(20)21)10-16(13)17(18)14-8-11(2)7-12(3)9-14/h5-10,17H,4,18H2,1-3H3