[2-methyl-4-(1-oxidanylcyclohexyl)-3,4-dihydro-1H-isoquinolin-7-yl] 2-methylpropyl carbonate

Systemtic Name: [2-methyl-4-(1-oxidanylcyclohexyl)-3,4-dihydro-1H-isoquinolin-7-yl] 2-methylpropyl carbonate Openeye Name: [4-(1-hydroxycyclohexyl)-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] isobutyl carbonate CAS Name: carbonic acid [4-(1-hydroxycyclohexyl)-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] 2-methylpropyl ester IUPAC Name: [4-(1-hydroxycyclohexyl)-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] 2-methylpropyl carbonate Traditional Name: carbonic acid [4-(1-hydroxycyclohexyl)-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] isobutyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)OC1=CC2=C(C=C1)C(CN(C2)C)C3(CCCCC3)O

Isomeric SMILES

CC(C)COC(=O)OC1=CC2=C(C=C1)C(CN(C2)C)C3(CCCCC3)O

InChI

InChI=1S/C21H31NO4/c1-15(2)14-25-20(23)26-17-7-8-18-16(11-17)12-22(3)13-19(18)21(24)9-5-4-6-10-21/h7-8,11,15,19,24H,4-6,9-10,12-14H2,1-3H3