3-[4-(3-thiophen-2-ylpropyl)piperazin-4-ium-1-yl]aniline

Systemtic Name: 3-[4-(3-thiophen-2-ylpropyl)piperazin-4-ium-1-yl]aniline Openeye Name: 3-[4-[3-(2-thienyl)propyl]piperazin-4-ium-1-yl]aniline CAS Name: 3-[4-(3-thiophen-2-ylpropyl)-1-piperazin-4-iumyl]aniline IUPAC Name: 3-[4-(3-thiophen-2-ylpropyl)piperazin-4-ium-1-yl]aniline Traditional Name: [3-[4-[3-(2-thienyl)propyl]piperazin-4-ium-1-yl]phenyl]amine Formula: C17H24N3S+ MolecularWeight: 302.45756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC=CS2)C3=CC(=CC=C3)N

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC=CS2)C3=CC(=CC=C3)N

InChI

InChI=1S/C17H23N3S/c18-15-4-1-5-16(14-15)20-11-9-19(10-12-20)8-2-6-17-7-3-13-21-17/h1,3-5,7,13-14H,2,6,8-12,18H2/p+1