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

Systemtic Name: quinolin-8-yl (4Z)-4-[bis(azanyl)methylidenehydrazinylidene]-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylate Openeye Name: 8-quinolyl (4Z)-4-(diaminomethylenehydrazono)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylate CAS Name: (4Z)-4-(diaminomethylidenehydrazinylidene)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (4Z)-4-(diaminomethylidenehydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylate Traditional Name: (4Z)-4-(diaminomethylenehydrazono)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid 8-quinolyl ester Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NN=C(N)N)CC(C2)(C)C)C(=O)OC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N\N=C(N)N)/CC(C2)(C)C)C(=O)OC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H23N5O3/c1-12-17-14(26-27-21(23)24)10-22(2,3)11-16(17)29-19(12)20(28)30-15-8-4-6-13-7-5-9-25-18(13)15/h4-9H,10-11H2,1-3H3,(H4,23,24,27)/b26-14-