4-bromanyl-2-nitro-N-(3-piperazin-1-ylpropyl)aniline

Systemtic Name: 4-bromanyl-2-nitro-N-(3-piperazin-1-ylpropyl)aniline Openeye Name: 4-bromo-2-nitro-N-(3-piperazin-1-ylpropyl)aniline CAS Name: 4-bromo-2-nitro-N-[3-(1-piperazinyl)propyl]aniline IUPAC Name: 4-bromo-2-nitro-N-(3-piperazin-1-ylpropyl)aniline Traditional Name: (4-bromo-2-nitro-phenyl)-(3-piperazinopropyl)amine Formula: C13H19BrN4O2 MolecularWeight: 343.21956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)CCCNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H19BrN4O2/c14-11-2-3-12(13(10-11)18(19)20)16-4-1-7-17-8-5-15-6-9-17/h2-3,10,15-16H,1,4-9H2