3-[1-[(3-chloranyl-1-benzothiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholin-4-yl-propan-1-one

Systemtic Name: 3-[1-[(3-chloranyl-1-benzothiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholin-4-yl-propan-1-one Openeye Name: 3-[1-[(3-chlorobenzothiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholino-propan-1-one CAS Name: 3-[1-[(3-chloro-1-benzothiophen-2-yl)methyl]-4-piperidin-1-iumyl]-1-(4-morpholinyl)-1-propanone IUPAC Name: 3-[1-[(3-chloro-1-benzothiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholin-4-ylpropan-1-one Traditional Name: 3-[1-[(3-chlorobenzothiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholino-propan-1-one Formula: C21H28ClN2O2S+ MolecularWeight: 407.97722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H27ClN2O2S/c22-21-17-3-1-2-4-18(17)27-19(21)15-23-9-7-16(8-10-23)5-6-20(25)24-11-13-26-14-12-24/h1-4,16H,5-15H2/p+1