1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propan-1-one

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propan-1-one Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propan-1-one CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)-1-propanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propan-1-one Traditional Name: 1-[4-(4-methoxyphenyl)piperazino]-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propan-1-one Formula: C25H32N3O2+ MolecularWeight: 406.54048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC[NH+]3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC[NH+]3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2/c1-30-24-9-7-23(8-10-24)27-17-19-28(20-18-27)25(29)13-16-26-14-11-22(12-15-26)21-5-3-2-4-6-21/h2-11H,12-20H2,1H3/p+1