2-(2-ethoxycarbonyl-4-methyl-phenyl)-2-(1-methylpyrrolidin-3-yl)ethanoic acid

Systemtic Name: 2-(2-ethoxycarbonyl-4-methyl-phenyl)-2-(1-methylpyrrolidin-3-yl)ethanoic acid Openeye Name: 2-(2-ethoxycarbonyl-4-methyl-phenyl)-2-(1-methylpyrrolidin-3-yl)acetic acid CAS Name: 2-(2-ethoxycarbonyl-4-methylphenyl)-2-(1-methyl-3-pyrrolidinyl)acetic acid IUPAC Name: 2-(2-ethoxycarbonyl-4-methylphenyl)-2-(1-methylpyrrolidin-3-yl)acetic acid Traditional Name: 2-(2-carbethoxy-4-methyl-phenyl)-2-(1-methylpyrrolidin-3-yl)acetic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)C)C(C2CCN(C2)C)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)C)C(C2CCN(C2)C)C(=O)O

InChI

InChI=1S/C17H23NO4/c1-4-22-17(21)14-9-11(2)5-6-13(14)15(16(19)20)12-7-8-18(3)10-12/h5-6,9,12,15H,4,7-8,10H2,1-3H3,(H,19,20)