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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C[NH+]2CCCC(C2)C(=O)N3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C[NH+]2CCC[C@H](C2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H32N2O4/c1-25-18-12-16(13-19(26-2)20(18)27-3)14-22-9-7-8-17(15-22)21(24)23-10-5-4-6-11-23/h12-13,17H,4-11,14-15H2,1-3H3/p+1/t17-/m1/s1