N-[(4-methyl-3-nitro-phenyl)methyl]-3-propan-2-yl-aniline

Systemtic Name: N-[(4-methyl-3-nitro-phenyl)methyl]-3-propan-2-yl-aniline Openeye Name: 3-isopropyl-N-[(4-methyl-3-nitro-phenyl)methyl]aniline CAS Name: N-[(4-methyl-3-nitrophenyl)methyl]-3-propan-2-ylaniline IUPAC Name: N-[(4-methyl-3-nitrophenyl)methyl]-3-propan-2-ylaniline Traditional Name: m-cumenyl-(4-methyl-3-nitro-benzyl)amine Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=CC=CC(=C2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=CC=CC(=C2)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O2/c1-12(2)15-5-4-6-16(10-15)18-11-14-8-7-13(3)17(9-14)19(20)21/h4-10,12,18H,11H2,1-3H3