[(3S)-1-[(3-ethoxy-4-methoxy-phenyl)methyl]-3-[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(3-ethoxy-4-methoxy-phenyl)methyl]-3-[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(3-ethoxy-4-methoxy-phenyl)methyl]-3-(o-tolylmethyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(3-ethoxy-4-methoxyphenyl)methyl]-3-[(2-methylphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(3-ethoxy-4-methoxyphenyl)methyl]-3-[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(3-ethoxy-4-methoxy-benzyl)-3-(2-methylbenzyl)piperidin-1-ium-3-yl]methanol Formula: C24H34NO3+ MolecularWeight: 384.53166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CCCC(C2)(CC3=CC=CC=C3C)CO)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCC[C@@](C2)(CC3=CC=CC=C3C)CO)OC

InChI

InChI=1S/C24H33NO3/c1-4-28-23-14-20(10-11-22(23)27-3)16-25-13-7-12-24(17-25,18-26)15-21-9-6-5-8-19(21)2/h5-6,8-11,14,26H,4,7,12-13,15-18H2,1-3H3/p+1/t24-/m0/s1