[(3S)-1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]-(6-methoxynaphthalen-2-yl)methanone

Systemtic Name: [(3S)-1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]-(6-methoxynaphthalen-2-yl)methanone Openeye Name: [(3S)-1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]-(6-methoxy-2-naphthyl)methanone CAS Name: [(3S)-1-[(4-hydroxyphenyl)methyl]-3-piperidin-1-iumyl]-(6-methoxy-2-naphthalenyl)methanone IUPAC Name: [(3S)-1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]-(6-methoxynaphthalen-2-yl)methanone Traditional Name: [(3S)-1-(4-hydroxybenzyl)piperidin-1-ium-3-yl]-(6-methoxy-2-naphthyl)methanone Formula: C24H26NO3+ MolecularWeight: 376.46814

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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=CC=C(C=C4)O

Isomeric SMILES

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

InChI

InChI=1S/C24H25NO3/c1-28-23-11-8-18-13-20(7-6-19(18)14-23)24(27)21-3-2-12-25(16-21)15-17-4-9-22(26)10-5-17/h4-11,13-14,21,26H,2-3,12,15-16H2,1H3/p+1/t21-/m0/s1