4-bromanyl-N-heptan-4-yl-2-nitro-aniline

Systemtic Name: 4-bromanyl-N-heptan-4-yl-2-nitro-aniline Openeye Name: 4-bromo-2-nitro-N-(1-propylbutyl)aniline CAS Name: 4-bromo-N-heptan-4-yl-2-nitroaniline IUPAC Name: 4-bromo-N-heptan-4-yl-2-nitroaniline Traditional Name: (4-bromo-2-nitro-phenyl)-(1-propylbutyl)amine Formula: C13H19BrN2O2 MolecularWeight: 315.20616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=C(C=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCCC(CCC)NC1=C(C=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H19BrN2O2/c1-3-5-11(6-4-2)15-12-8-7-10(14)9-13(12)16(17)18/h7-9,11,15H,3-6H2,1-2H3