N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C26H37N3O2+2 MolecularWeight: 423.59088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3)[NH+]4CCCC4

InChI

InChI=1S/C26H35N3O2/c1-31-24-13-11-22(12-14-24)25(29-17-5-6-18-29)19-27-26(30)23-9-7-21(8-10-23)20-28-15-3-2-4-16-28/h7-14,25H,2-6,15-20H2,1H3,(H,27,30)/p+2/t25-/m0/s1