ethyl 1-(3-bromophenyl)-4-[(3-methylphenyl)methoxy]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-[(3-methylphenyl)methoxy]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-(m-tolylmethoxy)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-[(3-methylphenyl)methoxy]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-[(3-methylphenyl)methoxy]-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-6-keto-4-(3-methylbenzyl)oxy-pyridazine-3-carboxylic acid ethyl ester Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OCC2=CC=CC(=C2)C)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OCC2=CC=CC(=C2)C)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H19BrN2O4/c1-3-27-21(26)20-18(28-13-15-7-4-6-14(2)10-15)12-19(25)24(23-20)17-9-5-8-16(22)11-17/h4-12H,3,13H2,1-2H3