ethyl 1-(3-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethoxy]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethoxy]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethoxy]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethoxy]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethoxy]-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethoxy]-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C23H20BrN3O7 MolecularWeight: 530.3248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H20BrN3O7/c1-2-31-23(30)22-19(12-21(29)27(26-22)16-5-3-4-14(24)10-16)34-13-20(28)25-15-6-7-17-18(11-15)33-9-8-32-17/h3-7,10-12H,2,8-9,13H2,1H3,(H,25,28)