2-chloranyl-N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-4-nitro-aniline

Systemtic Name: 2-chloranyl-N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-4-nitro-aniline Openeye Name: 2-chloro-N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-4-nitro-aniline CAS Name: 2-chloro-N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-4-nitroaniline IUPAC Name: 2-chloro-N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]amine Formula: C19H24ClN4O2+ MolecularWeight: 375.87246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H23ClN4O2/c1-15-3-2-4-16(13-15)23-11-9-22(10-12-23)8-7-21-19-6-5-17(24(25)26)14-18(19)20/h2-6,13-14,21H,7-12H2,1H3/p+1