cyclohexyloxycarbonyloxymethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: cyclohexyloxycarbonyloxymethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: cyclohexoxycarbonyloxymethyl 1-ethyl-5-(4-isoquinolylamino)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-ethyl-5-(4-isoquinolinylamino)-6-oxo-3-pyridazinecarboxylic acid [cyclohexyloxy(oxo)methoxy]methyl ester IUPAC Name: cyclohexyloxycarbonyloxymethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxopyridazine-3-carboxylate Traditional Name: 1-ethyl-5-(4-isoquinolylamino)-6-keto-pyridazine-3-carboxylic acid cyclohexoxycarbonyloxymethyl ester Formula: C24H26N4O6 MolecularWeight: 466.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC(=N1)C(=O)OCOC(=O)OC2CCCCC2)NC3=CN=CC4=CC=CC=C43

Isomeric SMILES

CCN1C(=O)C(=CC(=N1)C(=O)OCOC(=O)OC2CCCCC2)NC3=CN=CC4=CC=CC=C43

InChI

InChI=1S/C24H26N4O6/c1-2-28-22(29)19(26-21-14-25-13-16-8-6-7-11-18(16)21)12-20(27-28)23(30)32-15-33-24(31)34-17-9-4-3-5-10-17/h6-8,11-14,17,26H,2-5,9-10,15H2,1H3