1-[2-[[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C17H24N3O4+ MolecularWeight: 334.39016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCO2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C17H23N3O4/c1-11(13-2-3-14-15(8-13)24-10-23-14)19-16(21)9-20-6-4-12(5-7-20)17(18)22/h2-3,8,11-12H,4-7,9-10H2,1H3,(H2,18,22)(H,19,21)/p+1/t11-/m1/s1