4-(2-cyanophenyl)-2-methyl-6-pyrrolidin-1-yl-3,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(2-cyanophenyl)-2-methyl-6-pyrrolidin-1-yl-3,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(2-cyanophenyl)-2-methyl-6-pyrrolidin-1-yl-3,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(2-cyanophenyl)-2-methyl-6-(1-pyrrolidinyl)-3,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2-cyanophenyl)-2-methyl-6-pyrrolidin-1-yl-3,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(2-cyanophenyl)-2-methyl-6-pyrrolidino-3,4-dihydropyridine-3,5-dicarboxylic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)O)C2=CC=CC=C2C#N)C(=O)O)N3CCCC3

Isomeric SMILES

CC1=NC(=C(C(C1C(=O)O)C2=CC=CC=C2C#N)C(=O)O)N3CCCC3

InChI

InChI=1S/C19H19N3O4/c1-11-14(18(23)24)15(13-7-3-2-6-12(13)10-20)16(19(25)26)17(21-11)22-8-4-5-9-22/h2-3,6-7,14-15H,4-5,8-9H2,1H3,(H,23,24)(H,25,26)