1-[(1S)-7-methoxy-1-methyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-morpholin-4-ium-4-yl-ethanone

Systemtic Name: 1-[(1S)-7-methoxy-1-methyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-morpholin-4-ium-4-yl-ethanone Openeye Name: 1-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-morpholin-4-ium-4-yl-ethanone CAS Name: 1-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-(4-morpholin-4-iumyl)ethanone IUPAC Name: 1-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-morpholin-4-ium-4-ylethanone Traditional Name: 1-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-morpholin-4-ium-4-yl-ethanone Formula: C17H25N2O4+ MolecularWeight: 321.3914

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C(=O)C[NH+]3CCOCC3)O)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CCN1C(=O)C[NH+]3CCOCC3)O)OC

InChI

InChI=1S/C17H24N2O4/c1-12-14-10-16(22-2)15(20)9-13(14)3-4-19(12)17(21)11-18-5-7-23-8-6-18/h9-10,12,20H,3-8,11H2,1-2H3/p+1/t12-/m0/s1