methyl 2-[methyl-[3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxyphenyl]carbonyl-amino]ethanoate

Systemtic Name: methyl 2-[methyl-[3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxyphenyl]carbonyl-amino]ethanoate Openeye Name: methyl 2-[methyl-[3-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]benzoyl]amino]acetate CAS Name: 2-[methyl-[[3-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxybenzoyl]amino]acetate Traditional Name: 2-[methyl-[3-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]benzoyl]amino]acetic acid methyl ester Formula: C22H34N3O4+ MolecularWeight: 404.52306

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=CC=CC(=C3)C(=O)N(C)CC(=O)OC

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=CC=CC(=C3)C(=O)N(C)CC(=O)OC

InChI

InChI=1S/C22H33N3O4/c1-23-11-7-18(8-12-23)25-13-9-19(10-14-25)29-20-6-4-5-17(15-20)22(27)24(2)16-21(26)28-3/h4-6,15,18-19H,7-14,16H2,1-3H3/p+1