ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2-methyl-3,7a-dihydro-2H-1-benzofuran-3a-carboxylate

Systemtic Name: ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2-methyl-3,7a-dihydro-2H-1-benzofuran-3a-carboxylate Openeye Name: ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2-methyl-3,7a-dihydro-2H-benzofuran-3a-carboxylate CAS Name: 6,7-dicyano-4-[[ethoxy(phenylimino)methyl]amino]-2-methyl-3,7a-dihydro-2H-benzofuran-3a-carboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenylcarbonimidoyl)amino]-2-methyl-3,7a-dihydro-2H-1-benzofuran-3a-carboxylate Traditional Name: 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2-methyl-3,7a-dihydro-2H-benzofuran-3a-carboxylic acid ethyl ester Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CC(OC1C(=C(C=C2NC(=NC3=CC=CC=C3)OCC)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C12CC(OC1C(=C(C=C2NC(=NC3=CC=CC=C3)OCC)C#N)C#N)C

InChI

InChI=1S/C23H24N4O4/c1-4-29-21(28)23-12-15(3)31-20(23)18(14-25)16(13-24)11-19(23)27-22(30-5-2)26-17-9-7-6-8-10-17/h6-11,15,20H,4-5,12H2,1-3H3,(H,26,27)