2-(6-chloranyl-3-ethoxycarbonyl-pyridin-2-yl)-2-(1-methylpyrrolidin-3-yl)ethanoic acid

Systemtic Name: 2-(6-chloranyl-3-ethoxycarbonyl-pyridin-2-yl)-2-(1-methylpyrrolidin-3-yl)ethanoic acid Openeye Name: 2-(6-chloro-3-ethoxycarbonyl-2-pyridyl)-2-(1-methylpyrrolidin-3-yl)acetic acid CAS Name: 2-(6-chloro-3-ethoxycarbonyl-2-pyridinyl)-2-(1-methyl-3-pyrrolidinyl)acetic acid IUPAC Name: 2-(6-chloro-3-ethoxycarbonylpyridin-2-yl)-2-(1-methylpyrrolidin-3-yl)acetic acid Traditional Name: 2-(3-carbethoxy-6-chloro-2-pyridyl)-2-(1-methylpyrrolidin-3-yl)acetic acid Formula: C15H19ClN2O4 MolecularWeight: 326.77536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C=C1)Cl)C(C2CCN(C2)C)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(N=C(C=C1)Cl)C(C2CCN(C2)C)C(=O)O

InChI

InChI=1S/C15H19ClN2O4/c1-3-22-15(21)10-4-5-11(16)17-13(10)12(14(19)20)9-6-7-18(2)8-9/h4-5,9,12H,3,6-8H2,1-2H3,(H,19,20)