(6-methoxynaphthalen-2-yl)-[(3S)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (6-methoxynaphthalen-2-yl)-[(3S)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (6-methoxy-2-naphthyl)-[(3S)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (6-methoxy-2-naphthalenyl)-[(3S)-1-[(1-methyl-2-benzimidazolyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (6-methoxynaphthalen-2-yl)-[(3S)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (6-methoxy-2-naphthyl)-[(3S)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C[NH+]3CCCC(C3)C(=O)C4=CC5=C(C=C4)C=C(C=C5)OC

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C[NH+]3CCC[C@@H](C3)C(=O)C4=CC5=C(C=C4)C=C(C=C5)OC

InChI

InChI=1S/C26H27N3O2/c1-28-24-8-4-3-7-23(24)27-25(28)17-29-13-5-6-21(16-29)26(30)20-10-9-19-15-22(31-2)12-11-18(19)14-20/h3-4,7-12,14-15,21H,5-6,13,16-17H2,1-2H3/p+1/t21-/m0/s1