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

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-3-propan-2-yl-aniline Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-3-isopropyl-aniline CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-propan-2-ylaniline IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-propan-2-ylaniline Traditional Name: (4-bromo-3-nitro-benzyl)-m-cumenyl-amine Formula: C16H17BrN2O2 MolecularWeight: 349.22238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17BrN2O2/c1-11(2)13-4-3-5-14(9-13)18-10-12-6-7-15(17)16(8-12)19(20)21/h3-9,11,18H,10H2,1-2H3