1,2-dihydroacenaphthylen-5-yl-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]methanone CAS Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-(2-pyridinylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]methanone Traditional Name: acenaphthen-5-yl-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]methanone Formula: C24H25N2O+ MolecularWeight: 357.4681

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=N2)C(=O)C3=C4C=CC=C5C4=C(CC5)C=C3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=N2)C(=O)C3=C4C=CC=C5C4=C(CC5)C=C3

InChI

InChI=1S/C24H24N2O/c27-24(19-6-4-14-26(15-19)16-20-7-1-2-13-25-20)22-12-11-18-10-9-17-5-3-8-21(22)23(17)18/h1-3,5,7-8,11-13,19H,4,6,9-10,14-16H2/p+1/t19-/m0/s1