4-chloranyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-nitro-aniline

Systemtic Name: 4-chloranyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-nitro-aniline Openeye Name: 4-chloro-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-nitro-aniline CAS Name: 4-chloro-N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-nitroaniline IUPAC Name: 4-chloro-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-nitroaniline Traditional Name: (4-chloro-2-nitro-phenyl)-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amine Formula: C18H22ClN4O2+ MolecularWeight: 361.84588

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H21ClN4O2/c1-2-21-9-11-22(12-10-21)16-6-4-15(5-7-16)20-17-8-3-14(19)13-18(17)23(24)25/h3-8,13,20H,2,9-12H2,1H3/p+1