methyl 2-[4-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzoate

Systemtic Name: methyl 2-[4-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzoate Openeye Name: methyl 2-[4-[3-(4-ethoxyphenyl)-6-oxo-pyridazin-1-yl]butanoylamino]benzoate CAS Name: 2-[[4-[3-(4-ethoxyphenyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]butanoylamino]benzoate Traditional Name: 2-[4-(6-keto-3-p-phenetyl-pyridazin-1-yl)butanoylamino]benzoic acid methyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C24H25N3O5/c1-3-32-18-12-10-17(11-13-18)20-14-15-23(29)27(26-20)16-6-9-22(28)25-21-8-5-4-7-19(21)24(30)31-2/h4-5,7-8,10-15H,3,6,9,16H2,1-2H3,(H,25,28)