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

Systemtic Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-[(2-methylthiazol-5-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-[(2-methyl-5-thiazolyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: 1,2-dihydroacenaphthylen-5-yl-[(3S)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: acenaphthen-5-yl-[(3S)-1-[(2-methylthiazol-5-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C23H25N2OS+ MolecularWeight: 377.5224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(S1)C[NH+]2CCCC(C2)C(=O)C3=C4C=CC=C5C4=C(CC5)C=C3

Isomeric SMILES

CC1=NC=C(S1)C[NH+]2CCC[C@@H](C2)C(=O)C3=C4C=CC=C5C4=C(CC5)C=C3

InChI

InChI=1S/C23H24N2OS/c1-15-24-12-19(27-15)14-25-11-3-5-18(13-25)23(26)21-10-9-17-8-7-16-4-2-6-20(21)22(16)17/h2,4,6,9-10,12,18H,3,5,7-8,11,13-14H2,1H3/p+1/t18-/m0/s1