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

Systemtic Name: (phenylmethyl) 7-[(4-ethoxycarbonylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: benzyl 7-[(4-ethoxycarbonyl-4-piperidyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-[(4-ethoxycarbonyl-4-piperidinyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-[(4-ethoxycarbonylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 7-[(4-carbethoxy-4-piperidyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester Formula: C26H32N2O5 MolecularWeight: 452.54268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCNCC1)COC2=CC3=C(CCN(C3)C(=O)OCC4=CC=CC=C4)C=C2

Isomeric SMILES

CCOC(=O)C1(CCNCC1)COC2=CC3=C(CCN(C3)C(=O)OCC4=CC=CC=C4)C=C2

InChI

InChI=1S/C26H32N2O5/c1-2-31-24(29)26(11-13-27-14-12-26)19-33-23-9-8-21-10-15-28(17-22(21)16-23)25(30)32-18-20-6-4-3-5-7-20/h3-9,16,27H,2,10-15,17-19H2,1H3