4-[(1S)-1-(4-phenylpiperazin-1-ium-1-yl)propyl]aniline

Systemtic Name: 4-[(1S)-1-(4-phenylpiperazin-1-ium-1-yl)propyl]aniline Openeye Name: 4-[(1S)-1-(4-phenylpiperazin-1-ium-1-yl)propyl]aniline CAS Name: 4-[(1S)-1-(4-phenyl-1-piperazin-1-iumyl)propyl]aniline IUPAC Name: 4-[(1S)-1-(4-phenylpiperazin-1-ium-1-yl)propyl]aniline Traditional Name: [4-[(1S)-1-(4-phenylpiperazin-1-ium-1-yl)propyl]phenyl]amine Formula: C19H26N3+ MolecularWeight: 296.42984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)N)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)N)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H25N3/c1-2-19(16-8-10-17(20)11-9-16)22-14-12-21(13-15-22)18-6-4-3-5-7-18/h3-11,19H,2,12-15,20H2,1H3/p+1/t19-/m0/s1