1-(2,4-dimethoxyphenyl)carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethoxyphenyl)carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethoxybenzoyl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[(2,4-dimethoxyphenyl)-oxomethyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethoxybenzoyl)-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-(2,4-dimethoxybenzoyl)-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C20H30N3O4+ MolecularWeight: 376.4699

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3)OC

InChI

InChI=1S/C20H29N3O4/c1-26-15-6-7-16(17(14-15)27-2)18(24)22-12-8-20(9-13-22,19(21)25)23-10-4-3-5-11-23/h6-7,14H,3-5,8-13H2,1-2H3,(H2,21,25)/p+1