3,3-dimethyl-4-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]carbonyl-piperazin-2-one

Systemtic Name: 3,3-dimethyl-4-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]carbonyl-piperazin-2-one Openeye Name: 3,3-dimethyl-4-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carbonyl]piperazin-2-one CAS Name: 3,3-dimethyl-4-[oxo-[5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenyl]methyl]-2-piperazinone IUPAC Name: 3,3-dimethyl-4-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carbonyl]piperazin-2-one Traditional Name: 3,3-dimethyl-4-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carbonyl]piperazin-2-one Formula: C15H22N3O2S+ MolecularWeight: 308.41908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NCCN1C(=O)C2=CC=C(S2)C3CCC[NH2+]3)C

Isomeric SMILES

CC1(C(=O)NCCN1C(=O)C2=CC=C(S2)[C@H]3CCC[NH2+]3)C

InChI

InChI=1S/C15H21N3O2S/c1-15(2)14(20)17-8-9-18(15)13(19)12-6-5-11(21-12)10-4-3-7-16-10/h5-6,10,16H,3-4,7-9H2,1-2H3,(H,17,20)/p+1/t10-/m1/s1