(3R)-1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(indan-5-ylamino)-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-(indan-5-ylamino)-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NC2=CC3=C(CCC3)C=C2)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC(=O)NC2=CC3=C(CCC3)C=C2)C(=O)N

InChI

InChI=1S/C17H23N3O2/c18-17(22)14-5-2-8-20(10-14)11-16(21)19-15-7-6-12-3-1-4-13(12)9-15/h6-7,9,14H,1-5,8,10-11H2,(H2,18,22)(H,19,21)/p+1/t14-/m1/s1