(6-methoxynaphthalen-2-yl)-[(3S)-1-(pyridin-3-ylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: (6-methoxynaphthalen-2-yl)-[(3S)-1-(pyridin-3-ylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: (6-methoxy-2-naphthyl)-[(3S)-1-(3-pyridylmethyl)piperidin-1-ium-3-yl]methanone CAS Name: (6-methoxy-2-naphthalenyl)-[(3S)-1-(3-pyridinylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: (6-methoxynaphthalen-2-yl)-[(3S)-1-(pyridin-3-ylmethyl)piperidin-1-ium-3-yl]methanone Traditional Name: (6-methoxy-2-naphthyl)-[(3S)-1-(3-pyridylmethyl)piperidin-1-ium-3-yl]methanone Formula: C23H25N2O2+ MolecularWeight: 361.4568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C(=O)C3CCC[NH+](C3)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)C(=O)[C@H]3CCC[NH+](C3)CC4=CN=CC=C4

InChI

InChI=1S/C23H24N2O2/c1-27-22-9-8-18-12-20(7-6-19(18)13-22)23(26)21-5-3-11-25(16-21)15-17-4-2-10-24-14-17/h2,4,6-10,12-14,21H,3,5,11,15-16H2,1H3/p+1/t21-/m0/s1