3-[1-(2-methoxypyridin-3-yl)carbonylpiperidin-4-yl]-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide

Systemtic Name: 3-[1-(2-methoxypyridin-3-yl)carbonylpiperidin-4-yl]-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-[1-(2-methoxypyridine-3-carbonyl)-4-piperidyl]propanamide CAS Name: 3-[1-[(2-methoxy-3-pyridinyl)-oxomethyl]-4-piperidinyl]-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]propanamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-[1-(2-methoxypyridine-3-carbonyl)piperidin-4-yl]propanamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-[1-(2-methoxynicotinoyl)-4-piperidyl]propionamide Formula: C26H35N4O3+ MolecularWeight: 451.5811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C(=O)N2CCC(CC2)CCC(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC=N1)C(=O)N2CCC(CC2)CCC(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H34N4O3/c1-33-25-23(8-5-14-27-25)26(32)30-16-11-20(12-17-30)9-10-24(31)28-22-13-15-29(19-22)18-21-6-3-2-4-7-21/h2-8,14,20,22H,9-13,15-19H2,1H3,(H,28,31)/p+1/t22-/m0/s1