ethyl 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-1H-pyrazole-4-carboxylate CAS Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-1H-pyrazole-4-carboxylate Traditional Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C17H21N3O6S/c1-4-26-17(21)13-9-18-19-16(13)27(22,23)20-6-5-11-7-14(24-2)15(25-3)8-12(11)10-20/h7-9H,4-6,10H2,1-3H3,(H,18,19)