2-(3-methoxyphenyl)-N-[(2R)-2-(4-propan-2-ylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(3-methoxyphenyl)-N-[(2R)-2-(4-propan-2-ylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-4-carboxamide Openeye Name: N-[(2R)-2-(4-isopropylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-methoxyphenyl)quinoline-4-carboxamide CAS Name: 2-(3-methoxyphenyl)-N-[(2R)-2-(4-propan-2-ylphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-methoxyphenyl)-N-[(2R)-2-(4-propan-2-ylphenyl)-2-pyrrolidin-1-ium-1-ylethyl]quinoline-4-carboxamide Traditional Name: 2-(3-methoxyphenyl)-N-[(2R)-2-p-cumenyl-2-pyrrolidin-1-ium-1-yl-ethyl]cinchoninamide Formula: C32H36N3O2+ MolecularWeight: 494.64714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OC)[NH+]5CCCC5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@H](CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OC)[NH+]5CCCC5

InChI

InChI=1S/C32H35N3O2/c1-22(2)23-13-15-24(16-14-23)31(35-17-6-7-18-35)21-33-32(36)28-20-30(25-9-8-10-26(19-25)37-3)34-29-12-5-4-11-27(28)29/h4-5,8-16,19-20,22,31H,6-7,17-18,21H2,1-3H3,(H,33,36)/p+1/t31-/m0/s1