methyl 2-(2-azanyl-2-cyclohexyl-ethanoyl)-7-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(2-azanyl-2-cyclohexyl-ethanoyl)-7-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-(2-amino-2-cyclohexyl-acetyl)-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-(2-amino-2-cyclohexyl-1-oxoethyl)-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-amino-2-cyclohexylacetyl)-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-(2-amino-2-cyclohexyl-acetyl)-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=C(CN1C(=O)C(C3CCCCC3)N)C=C(C=C2)O

Isomeric SMILES

COC(=O)C1CC2=C(CN1C(=O)C(C3CCCCC3)N)C=C(C=C2)O

InChI

InChI=1S/C19H26N2O4/c1-25-19(24)16-10-13-7-8-15(22)9-14(13)11-21(16)18(23)17(20)12-5-3-2-4-6-12/h7-9,12,16-17,22H,2-6,10-11,20H2,1H3