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

Systemtic Name: (phenylmethyl) 7-[[4-ethoxycarbonyl-1-(2-methylpyridin-4-yl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: benzyl 7-[[4-ethoxycarbonyl-1-(2-methyl-4-pyridyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-[[4-ethoxycarbonyl-1-(2-methyl-4-pyridinyl)-4-piperidinyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-[[4-ethoxycarbonyl-1-(2-methylpyridin-4-yl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 7-[[4-carbethoxy-1-(2-methyl-4-pyridyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester Formula: C32H37N3O5 MolecularWeight: 543.65328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C2=CC(=NC=C2)C)COC3=CC4=C(CCN(C4)C(=O)OCC5=CC=CC=C5)C=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C2=CC(=NC=C2)C)COC3=CC4=C(CCN(C4)C(=O)OCC5=CC=CC=C5)C=C3

InChI

InChI=1S/C32H37N3O5/c1-3-38-30(36)32(13-17-34(18-14-32)28-11-15-33-24(2)19-28)23-40-29-10-9-26-12-16-35(21-27(26)20-29)31(37)39-22-25-7-5-4-6-8-25/h4-11,15,19-20H,3,12-14,16-18,21-23H2,1-2H3