1-(1,2-thiazepin-2-ium-2-ylmethyl)pyrrolidin-2-one

Systemtic Name: 1-(1,2-thiazepin-2-ium-2-ylmethyl)pyrrolidin-2-one Openeye Name: 1-(thiazepin-2-ium-2-ylmethyl)pyrrolidin-2-one CAS Name: 1-(2-thiazepin-2-iumylmethyl)-2-pyrrolidinone IUPAC Name: 1-(thiazepin-2-ium-2-ylmethyl)pyrrolidin-2-one Traditional Name: 1-(thiazepin-2-ium-2-ylmethyl)-2-pyrrolidone Formula: C10H13N2OS+ MolecularWeight: 209.28802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C[N+]2=CC=CC=CS2

Isomeric SMILES

C1CC(=O)N(C1)C[N+]2=CC=CC=CS2

InChI

InChI=1S/C10H13N2OS/c13-10-5-4-6-11(10)9-12-7-2-1-3-8-14-12/h1-3,7-8H,4-6,9H2/q+1