quinolin-8-yl (4E)-4-[bis(azanyl)methylidenehydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: quinolin-8-yl (4E)-4-[bis(azanyl)methylidenehydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 8-quinolyl (4E)-4-(diaminomethylenehydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-(diaminomethylidenehydrazinylidene)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (4E)-4-(diaminomethylidenehydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-(diaminomethylenehydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 8-quinolyl ester Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NN=C(N)N)CCC2)C(=O)OC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/N=C(N)N)/CCC2)C(=O)OC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H19N5O3/c1-11-16-13(24-25-20(21)22)7-3-8-14(16)27-18(11)19(26)28-15-9-2-5-12-6-4-10-23-17(12)15/h2,4-6,9-10H,3,7-8H2,1H3,(H4,21,22,25)/b24-13+