N-[(1S,2S)-2-piperidin-1-ium-1-yl-1,2-dihydroacenaphthylen-1-yl]methanesulfonamide

Systemtic Name: N-[(1S,2S)-2-piperidin-1-ium-1-yl-1,2-dihydroacenaphthylen-1-yl]methanesulfonamide Openeye Name: N-[(1S,2S)-2-piperidin-1-ium-1-yl-1,2-dihydroacenaphthylen-1-yl]methanesulfonamide CAS Name: N-[(1S,2S)-2-(1-piperidin-1-iumyl)-1,2-dihydroacenaphthylen-1-yl]methanesulfonamide IUPAC Name: N-[(1S,2S)-2-piperidin-1-ium-1-yl-1,2-dihydroacenaphthylen-1-yl]methanesulfonamide Traditional Name: N-[(1S,2S)-2-piperidin-1-ium-1-ylacenaphthen-1-yl]methanesulfonamide Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1C(C2=CC=CC3=C2C1=CC=C3)[NH+]4CCCCC4

Isomeric SMILES

CS(=O)(=O)N[C@@H]1[C@H](C2=CC=CC3=C2C1=CC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C18H22N2O2S/c1-23(21,22)19-17-14-9-5-7-13-8-6-10-15(16(13)14)18(17)20-11-3-2-4-12-20/h5-10,17-19H,2-4,11-12H2,1H3/p+1/t17-,18-/m0/s1