4-phenyl-1-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-phenyl-1-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)butan-1-one Openeye Name: 4-phenyl-1-(4-thiomorpholin-4-ium-4-yl-1-piperidyl)butan-1-one CAS Name: 4-phenyl-1-[4-(4-thiomorpholin-4-iumyl)-1-piperidinyl]-1-butanone IUPAC Name: 4-phenyl-1-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)butan-1-one Traditional Name: 4-phenyl-1-(4-thiomorpholin-4-ium-4-ylpiperidino)butan-1-one Formula: C19H29N2OS+ MolecularWeight: 333.51136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCSCC2)C(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1[NH+]2CCSCC2)C(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H28N2OS/c22-19(8-4-7-17-5-2-1-3-6-17)21-11-9-18(10-12-21)20-13-15-23-16-14-20/h1-3,5-6,18H,4,7-16H2/p+1