(3-methoxy-2-phenylmethoxy-phenyl)methyl-(piperidin-1-ium-4-ylmethyl)azanium

Systemtic Name: (3-methoxy-2-phenylmethoxy-phenyl)methyl-(piperidin-1-ium-4-ylmethyl)azanium Openeye Name: (2-benzyloxy-3-methoxy-phenyl)methyl-(piperidin-1-ium-4-ylmethyl)ammonium CAS Name: (3-methoxy-2-phenylmethoxyphenyl)methyl-(4-piperidin-1-iumylmethyl)ammonium IUPAC Name: (3-methoxy-2-phenylmethoxyphenyl)methyl-(piperidin-1-ium-4-ylmethyl)azanium Traditional Name: (2-benzoxy-3-methoxy-benzyl)-(piperidin-1-ium-4-ylmethyl)ammonium Formula: C21H30N2O2+2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=CC=C2)C[NH2+]CC3CC[NH2+]CC3

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=CC=C2)C[NH2+]CC3CC[NH2+]CC3

InChI

InChI=1S/C21H28N2O2/c1-24-20-9-5-8-19(15-23-14-17-10-12-22-13-11-17)21(20)25-16-18-6-3-2-4-7-18/h2-9,17,22-23H,10-16H2,1H3/p+2