2-[5-(dimethylamino)-3-ethoxycarbonyl-pyridin-2-yl]-2-(1-methylpyrrolidin-3-yl)ethanoic acid

Systemtic Name: 2-[5-(dimethylamino)-3-ethoxycarbonyl-pyridin-2-yl]-2-(1-methylpyrrolidin-3-yl)ethanoic acid Openeye Name: 2-[5-(dimethylamino)-3-ethoxycarbonyl-2-pyridyl]-2-(1-methylpyrrolidin-3-yl)acetic acid CAS Name: 2-[5-(dimethylamino)-3-ethoxycarbonyl-2-pyridinyl]-2-(1-methyl-3-pyrrolidinyl)acetic acid IUPAC Name: 2-[5-(dimethylamino)-3-ethoxycarbonylpyridin-2-yl]-2-(1-methylpyrrolidin-3-yl)acetic acid Traditional Name: 2-[3-carbethoxy-5-(dimethylamino)-2-pyridyl]-2-(1-methylpyrrolidin-3-yl)acetic acid Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN=C1C(C2CCN(C2)C)C(=O)O)N(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CN=C1C(C2CCN(C2)C)C(=O)O)N(C)C

InChI

InChI=1S/C17H25N3O4/c1-5-24-17(23)13-8-12(19(2)3)9-18-15(13)14(16(21)22)11-6-7-20(4)10-11/h8-9,11,14H,5-7,10H2,1-4H3,(H,21,22)