[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium

Systemtic Name: [3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Openeye Name: [3-methoxy-4-(m-tolylmethoxy)phenyl]methyl-(piperidin-1-ium-4-ylmethyl)ammonium CAS Name: [3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methyl-(4-piperidin-1-iumylmethyl)ammonium IUPAC Name: [3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Traditional Name: [3-methoxy-4-(3-methylbenzyl)oxy-benzyl]-(piperidin-1-ium-4-ylmethyl)ammonium Formula: C22H32N2O2+2 MolecularWeight: 356.50168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=C(C=C(C=C2)C[NH2+]CC3CC[NH2+]CC3)OC

Isomeric SMILES

CC1=CC(=CC=C1)COC2=C(C=C(C=C2)C[NH2+]CC3CC[NH2+]CC3)OC

InChI

InChI=1S/C22H30N2O2/c1-17-4-3-5-20(12-17)16-26-21-7-6-19(13-22(21)25-2)15-24-14-18-8-10-23-11-9-18/h3-7,12-13,18,23-24H,8-11,14-16H2,1-2H3/p+2