(3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-prop-2-enyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-prop-2-enyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-allyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-(1-methyl-4-piperidin-1-iumyl)-N-prop-2-enyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-prop-2-enylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-allyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Formula: C15H29N3O+2 MolecularWeight: 267.41026

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCC=C

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCC=C

InChI

InChI=1S/C15H27N3O/c1-3-8-16-15(19)13-5-4-9-18(12-13)14-6-10-17(2)11-7-14/h3,13-14H,1,4-12H2,2H3,(H,16,19)/p+2/t13-/m0/s1