methyl 2-[2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]-7-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-[2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]-7-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[2-(tert-butoxycarbonylamino)-2-cyclohexyl-acetyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[2-cyclohexyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-[2-(tert-butoxycarbonylamino)-2-cyclohexyl-acetyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C24H34N2O6 MolecularWeight: 446.53656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1CCCCC1)C(=O)N2CC3=C(CC2C(=O)OC)C=CC(=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1CCCCC1)C(=O)N2CC3=C(CC2C(=O)OC)C=CC(=C3)O

InChI

InChI=1S/C24H34N2O6/c1-24(2,3)32-23(30)25-20(15-8-6-5-7-9-15)21(28)26-14-17-12-18(27)11-10-16(17)13-19(26)22(29)31-4/h10-12,15,19-20,27H,5-9,13-14H2,1-4H3,(H,25,30)