2-ethoxycarbonyl-7-[2-(6-ethoxypyridin-2-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-ethoxycarbonyl-7-[2-(6-ethoxypyridin-2-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-ethoxycarbonyl-7-[2-(6-ethoxy-2-pyridyl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-ethoxycarbonyl-7-[2-(6-ethoxy-2-pyridinyl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-ethoxycarbonyl-7-[2-(6-ethoxypyridin-2-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-carbethoxy-7-[2-(6-ethoxy-2-pyridyl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=N1)CCOC2=CC3=C(CC(N(C3)C(=O)OCC)C(=O)O)C=C2

Isomeric SMILES

CCOC1=CC=CC(=N1)CCOC2=CC3=C(CC(N(C3)C(=O)OCC)C(=O)O)C=C2

InChI

InChI=1S/C22H26N2O6/c1-3-28-20-7-5-6-17(23-20)10-11-30-18-9-8-15-13-19(21(25)26)24(14-16(15)12-18)22(27)29-4-2/h5-9,12,19H,3-4,10-11,13-14H2,1-2H3,(H,25,26)