N-[(4-bromanyl-3-nitro-phenyl)methyl]-3-phenyl-propan-1-amine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-3-phenyl-propan-1-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-3-phenyl-propan-1-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-phenyl-1-propanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-phenylpropan-1-amine Traditional Name: (4-bromo-3-nitro-benzyl)-(3-phenylpropyl)amine Formula: C16H17BrN2O2 MolecularWeight: 349.22238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCNCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H17BrN2O2/c17-15-9-8-14(11-16(15)19(20)21)12-18-10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11,18H,4,7,10,12H2