7-methoxy-1-methyl-2-(2-morpholin-4-ium-4-ylethanoyl)-3,4-dihydro-1H-isoquinolin-6-olate

Systemtic Name: 7-methoxy-1-methyl-2-(2-morpholin-4-ium-4-ylethanoyl)-3,4-dihydro-1H-isoquinolin-6-olate Openeye Name: 7-methoxy-1-methyl-2-(2-morpholin-4-ium-4-ylacetyl)-3,4-dihydro-1H-isoquinolin-6-olate CAS Name: 7-methoxy-1-methyl-2-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-3,4-dihydro-1H-isoquinolin-6-olate IUPAC Name: 7-methoxy-1-methyl-2-(2-morpholin-4-ium-4-ylacetyl)-3,4-dihydro-1H-isoquinolin-6-olate Traditional Name: 7-methoxy-1-methyl-2-(2-morpholin-4-ium-4-ylacetyl)-3,4-dihydro-1H-isoquinolin-6-olate Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1C2=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