7-[(4-ethoxycarbonylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 7-[(4-ethoxycarbonylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 7-[(4-ethoxycarbonyl-4-piperidyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 7-[(4-ethoxycarbonyl-4-piperidinyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 7-[(4-ethoxycarbonylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 7-[(4-carbethoxy-4-piperidyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCNCC1)COC2=CC3=C(CCN(C3)C(=O)O)C=C2

Isomeric SMILES

CCOC(=O)C1(CCNCC1)COC2=CC3=C(CCN(C3)C(=O)O)C=C2

InChI

InChI=1S/C19H26N2O5/c1-2-25-17(22)19(6-8-20-9-7-19)13-26-16-4-3-14-5-10-21(18(23)24)12-15(14)11-16/h3-4,11,20H,2,5-10,12-13H2,1H3,(H,23,24)