[(3R)-1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3R)-1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3R)-1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(3R)-1-[(2,4-dimethoxyphenyl)methyl]-3-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3R)-1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3R)-1-(2,4-dimethoxybenzyl)piperidin-1-ium-3-yl]-pyrrolidino-methanone Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCCC(C2)C(=O)N3CCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCC[C@H](C2)C(=O)N3CCCC3)OC

InChI

InChI=1S/C19H28N2O3/c1-23-17-8-7-15(18(12-17)24-2)13-20-9-5-6-16(14-20)19(22)21-10-3-4-11-21/h7-8,12,16H,3-6,9-11,13-14H2,1-2H3/p+1/t16-/m1/s1