3-chloranyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline

Systemtic Name: 3-chloranyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline Openeye Name: 3-chloro-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline CAS Name: 3-chloro-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]aniline IUPAC Name: 3-chloro-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]aniline Traditional Name: [3-chloro-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]amine Formula: C17H21ClN3+ MolecularWeight: 302.82174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=C(C=C2)N)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=C(C=C2)N)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H20ClN3/c18-17-12-15(19)7-6-14(17)13-20-8-10-21(11-9-20)16-4-2-1-3-5-16/h1-7,12H,8-11,13,19H2/p+1