1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(indan-5-ylamino)-3-oxo-propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxopropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxopropyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(indan-5-ylamino)-3-keto-propyl]piperidin-1-ium-4-carboxamide Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CC[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CC[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C18H25N3O2/c19-18(23)14-6-9-21(10-7-14)11-8-17(22)20-16-5-4-13-2-1-3-15(13)12-16/h4-5,12,14H,1-3,6-11H2,(H2,19,23)(H,20,22)/p+1