1-[2-(4-ethoxycarbonylpiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 1-[2-(4-ethoxycarbonylpiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 1-[2-(4-ethoxycarbonyl-4-piperidyl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 1-[2-(4-ethoxycarbonyl-4-piperidinyl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 1-[2-(4-ethoxycarbonylpiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 1-[2-(4-carbethoxy-4-piperidyl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCNCC1)CCOC2C3=CC=CC=C3CCN2C(=O)O

Isomeric SMILES

CCOC(=O)C1(CCNCC1)CCOC2C3=CC=CC=C3CCN2C(=O)O

InChI

InChI=1S/C20H28N2O5/c1-2-26-18(23)20(8-11-21-12-9-20)10-14-27-17-16-6-4-3-5-15(16)7-13-22(17)19(24)25/h3-6,17,21H,2,7-14H2,1H3,(H,24,25)