[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]-naphthalen-2-yl-methanone

Systemtic Name: [4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]-naphthalen-2-yl-methanone Openeye Name: [4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-yl]-(2-naphthyl)methanone CAS Name: [4-[(3S)-1,1-dioxo-3-thiolanyl]-1-piperazin-4-iumyl]-(2-naphthalenyl)methanone IUPAC Name: [4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-yl]-naphthalen-2-ylmethanone Traditional Name: [4-[(3S)-1,1-diketothiolan-3-yl]piperazin-4-ium-1-yl]-(2-naphthyl)methanone Formula: C19H23N2O3S+ MolecularWeight: 359.46252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C19H22N2O3S/c22-19(17-6-5-15-3-1-2-4-16(15)13-17)21-10-8-20(9-11-21)18-7-12-25(23,24)14-18/h1-6,13,18H,7-12,14H2/p+1/t18-/m0/s1