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

Systemtic Name: 3-[(S)-cyclopropyl-(4-phenylpiperazin-1-ium-1-yl)methyl]aniline Openeye Name: 3-[(S)-cyclopropyl-(4-phenylpiperazin-1-ium-1-yl)methyl]aniline CAS Name: 3-[(S)-cyclopropyl-(4-phenyl-1-piperazin-1-iumyl)methyl]aniline IUPAC Name: 3-[(S)-cyclopropyl-(4-phenylpiperazin-1-ium-1-yl)methyl]aniline Traditional Name: [3-[(S)-cyclopropyl-(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]amine Formula: C20H26N3+ MolecularWeight: 308.44054

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC(=CC=C2)N)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC1[C@@H](C2=CC(=CC=C2)N)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H25N3/c21-18-6-4-5-17(15-18)20(16-9-10-16)23-13-11-22(12-14-23)19-7-2-1-3-8-19/h1-8,15-16,20H,9-14,21H2/p+1/t20-/m0/s1