2-chloranyl-N-(3-imidazol-1-ylpropyl)-4-nitro-aniline

Systemtic Name: 2-chloranyl-N-(3-imidazol-1-ylpropyl)-4-nitro-aniline Openeye Name: 2-chloro-N-(3-imidazol-1-ylpropyl)-4-nitro-aniline CAS Name: 2-chloro-N-[3-(1-imidazolyl)propyl]-4-nitroaniline IUPAC Name: 2-chloro-N-(3-imidazol-1-ylpropyl)-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-(3-imidazol-1-ylpropyl)amine Formula: C12H13ClN4O2 MolecularWeight: 280.71022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NCCCN2C=CN=C2

InChI

InChI=1S/C12H13ClN4O2/c13-11-8-10(17(18)19)2-3-12(11)15-4-1-6-16-7-5-14-9-16/h2-3,5,7-9,15H,1,4,6H2