(2R)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propanamide

Systemtic Name: (2R)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propanamide Openeye Name: (2R)-N-[(3S)-1,1-dioxothiolan-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propanamide CAS Name: (2R)-N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-N-methylpropanamide IUPAC Name: (2R)-N-[(3S)-1,1-dioxothiolan-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-methylpropanamide Traditional Name: (2R)-N-[(3S)-1,1-diketothiolan-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-propionamide Formula: C19H30N3O4S+ MolecularWeight: 396.5242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCS(=O)(=O)C1)[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

C[C@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C19H29N3O4S/c1-15(19(23)20(2)16-8-13-27(24,25)14-16)21-9-11-22(12-10-21)17-6-4-5-7-18(17)26-3/h4-7,15-16H,8-14H2,1-3H3/p+1/t15-,16+/m1/s1