piperidin-1-yl-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: piperidin-1-yl-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: 1-piperidyl-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: 1-piperidinyl-[1-[(3,4,5-trimethoxyphenyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: piperidin-1-yl-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: piperidino-[1-(3,4,5-trimethoxybenzyl)piperidin-1-ium-4-yl]methanone Formula: C21H33N2O4+ MolecularWeight: 377.49772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H32N2O4/c1-25-18-13-16(14-19(26-2)20(18)27-3)15-22-11-7-17(8-12-22)21(24)23-9-5-4-6-10-23/h13-14,17H,4-12,15H2,1-3H3/p+1