cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxidanylidene-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxidanylidene-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxo-2-[4-(2-thienylmethyl)piperazin-1-yl]ethyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxo-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethyl]azanium Traditional Name: cyclopropyl-[2-keto-2-[4-(2-thenyl)piperazino]ethyl]-p-anisyl-ammonium Formula: C22H30N3O2S+ MolecularWeight: 400.5575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC(=O)N2CCN(CC2)CC3=CC=CS3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC(=O)N2CCN(CC2)CC3=CC=CS3)C4CC4

InChI

InChI=1S/C22H29N3O2S/c1-27-20-8-4-18(5-9-20)15-25(19-6-7-19)17-22(26)24-12-10-23(11-13-24)16-21-3-2-14-28-21/h2-5,8-9,14,19H,6-7,10-13,15-17H2,1H3/p+1