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

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-3-ethoxy-propan-1-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-3-ethoxy-propan-1-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-ethoxy-1-propanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-3-ethoxypropan-1-amine Traditional Name: (4-bromo-3-nitro-benzyl)-(3-ethoxypropyl)amine Formula: C12H17BrN2O3 MolecularWeight: 317.17898

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCOCCCNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H17BrN2O3/c1-2-18-7-3-6-14-9-10-4-5-11(13)12(8-10)15(16)17/h4-5,8,14H,2-3,6-7,9H2,1H3