2,6-bis(1-ethoxyethyl)-4-isoquinolin-1-yl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-bis(1-ethoxyethyl)-4-isoquinolin-1-yl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-bis(1-ethoxyethyl)-4-(1-isoquinolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-bis(1-ethoxyethyl)-4-(1-isoquinolinyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-bis(1-ethoxyethyl)-4-isoquinolin-1-yl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-bis(1-ethoxyethyl)-4-(1-isoquinolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C1=CC(C(=C(N1)C(C)OCC)C(=O)O)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

CCOC(C)C1=CC(C(=C(N1)C(C)OCC)C(=O)O)C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C23H28N2O4/c1-5-28-14(3)19-13-18(20(23(26)27)21(25-19)15(4)29-6-2)22-17-10-8-7-9-16(17)11-12-24-22/h7-15,18,25H,5-6H2,1-4H3,(H,26,27)