2-[4-(3-methoxyphenyl)-4-oxidanyl-piperidin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(3-methoxyphenyl)-4-oxidanyl-piperidin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-hydroxy-4-(3-methoxyphenyl)piperidin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-hydroxy-4-(3-methoxyphenyl)-1-piperidin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-hydroxy-4-(3-methoxyphenyl)piperidin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-hydroxy-4-(3-methoxyphenyl)piperidin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C18H27N2O3+ MolecularWeight: 319.41858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CC[NH+](CC2)CC(=O)N3CCCC3)O

Isomeric SMILES

COC1=CC=CC(=C1)C2(CC[NH+](CC2)CC(=O)N3CCCC3)O

InChI

InChI=1S/C18H26N2O3/c1-23-16-6-4-5-15(13-16)18(22)7-11-19(12-8-18)14-17(21)20-9-2-3-10-20/h4-6,13,22H,2-3,7-12,14H2,1H3/p+1