1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C16H27N4O4S+ MolecularWeight: 371.47498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3

InChI

InChI=1S/C16H26N4O4S/c1-12-14(13(2)24-18-12)25(22,23)20-10-6-16(7-11-20,15(17)21)19-8-4-3-5-9-19/h3-11H2,1-2H3,(H2,17,21)/p+1