N-[(4-bromanyl-3-nitro-phenyl)methyl]-2-pyrrolidin-1-yl-ethanamine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-2-pyrrolidin-1-yl-ethanamine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-2-pyrrolidin-1-yl-ethanamine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-2-(1-pyrrolidinyl)ethanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-2-pyrrolidin-1-ylethanamine Traditional Name: (4-bromo-3-nitro-benzyl)-(2-pyrrolidinoethyl)amine Formula: C13H18BrN3O2 MolecularWeight: 328.20492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CCNCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H18BrN3O2/c14-12-4-3-11(9-13(12)17(18)19)10-15-5-8-16-6-1-2-7-16/h3-4,9,15H,1-2,5-8,10H2