2-(3-ethoxycarbonyl-5-phenyl-pyridin-2-yl)-2-(1-methylpyrrolidin-3-yl)ethanoic acid

Systemtic Name: 2-(3-ethoxycarbonyl-5-phenyl-pyridin-2-yl)-2-(1-methylpyrrolidin-3-yl)ethanoic acid Openeye Name: 2-(3-ethoxycarbonyl-5-phenyl-2-pyridyl)-2-(1-methylpyrrolidin-3-yl)acetic acid CAS Name: 2-(3-ethoxycarbonyl-5-phenyl-2-pyridinyl)-2-(1-methyl-3-pyrrolidinyl)acetic acid IUPAC Name: 2-(3-ethoxycarbonyl-5-phenylpyridin-2-yl)-2-(1-methylpyrrolidin-3-yl)acetic acid Traditional Name: 2-(3-carbethoxy-5-phenyl-2-pyridyl)-2-(1-methylpyrrolidin-3-yl)acetic acid Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CC(=C1)C2=CC=CC=C2)C(C3CCN(C3)C)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(N=CC(=C1)C2=CC=CC=C2)C(C3CCN(C3)C)C(=O)O

InChI

InChI=1S/C21H24N2O4/c1-3-27-21(26)17-11-16(14-7-5-4-6-8-14)12-22-19(17)18(20(24)25)15-9-10-23(2)13-15/h4-8,11-12,15,18H,3,9-10,13H2,1-2H3,(H,24,25)