3-methyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]furan-2-carboxamide

Systemtic Name: 3-methyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]furan-2-carboxamide Openeye Name: 3-methyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]furan-2-carboxamide CAS Name: 3-methyl-N-[(3S)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinyl]-2-furancarboxamide IUPAC Name: 3-methyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]furan-2-carboxamide Traditional Name: 3-methyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]-2-furamide Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC=C1)C(=O)NC2CCCN(C2)C3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(OC=C1)C(=O)N[C@H]2CCCN(C2)C3CC[NH+](CC3)C

InChI

InChI=1S/C17H27N3O2/c1-13-7-11-22-16(13)17(21)18-14-4-3-8-20(12-14)15-5-9-19(2)10-6-15/h7,11,14-15H,3-6,8-10,12H2,1-2H3,(H,18,21)/p+1/t14-/m0/s1