1-[1-[(3-methoxyphenyl)methyl]piperidin-1-ium-4-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[1-[(3-methoxyphenyl)methyl]piperidin-1-ium-4-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[1-[(3-methoxyphenyl)methyl]piperidin-1-ium-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[1-[(3-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-[(3-methoxyphenyl)methyl]piperidin-1-ium-4-carbonyl]piperidine-4-carboxamide Traditional Name: 1-(1-m-anisylpiperidin-1-ium-4-carbonyl)isonipecotamide Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCC(CC2)C(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCC(CC2)C(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H29N3O3/c1-26-18-4-2-3-15(13-18)14-22-9-5-17(6-10-22)20(25)23-11-7-16(8-12-23)19(21)24/h2-4,13,16-17H,5-12,14H2,1H3,(H2,21,24)/p+1