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

Systemtic Name: 1-cyclohexyloxycarbonyloxyethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-3-phenyl-pyridazine-4-carboxylate Openeye Name: 1-(cyclohexoxycarbonyloxy)ethyl 1-ethyl-5-(4-isoquinolylamino)-6-oxo-3-phenyl-pyridazine-4-carboxylate CAS Name: 1-ethyl-5-(4-isoquinolinylamino)-6-oxo-3-phenyl-4-pyridazinecarboxylic acid 1-[cyclohexyloxy(oxo)methoxy]ethyl ester IUPAC Name: 1-cyclohexyloxycarbonyloxyethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxo-3-phenylpyridazine-4-carboxylate Traditional Name: 1-ethyl-5-(4-isoquinolylamino)-6-keto-3-phenyl-pyridazine-4-carboxylic acid 1-(cyclohexoxycarbonyloxy)ethyl ester Formula: C31H32N4O6 MolecularWeight: 556.60898

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C(=O)OC(C)OC(=O)OC3CCCCC3)NC4=CN=CC5=CC=CC=C54

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C(=O)OC(C)OC(=O)OC3CCCCC3)NC4=CN=CC5=CC=CC=C54

InChI

InChI=1S/C31H32N4O6/c1-3-35-29(36)28(33-25-19-32-18-22-14-10-11-17-24(22)25)26(27(34-35)21-12-6-4-7-13-21)30(37)39-20(2)40-31(38)41-23-15-8-5-9-16-23/h4,6-7,10-14,17-20,23,33H,3,5,8-9,15-16H2,1-2H3