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

Systemtic Name: ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2,2-dimethyl-3,7a-dihydro-1-benzofuran-3a-carboxylate Openeye Name: ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2,2-dimethyl-3,7a-dihydrobenzofuran-3a-carboxylate CAS Name: 6,7-dicyano-4-[[ethoxy(phenylimino)methyl]amino]-2,2-dimethyl-3,7a-dihydrobenzofuran-3a-carboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dicyano-4-[(C-ethoxy-N-phenylcarbonimidoyl)amino]-2,2-dimethyl-3,7a-dihydro-1-benzofuran-3a-carboxylate Traditional Name: 6,7-dicyano-4-[(C-ethoxy-N-phenyl-carbonimidoyl)amino]-2,2-dimethyl-3,7a-dihydrobenzofuran-3a-carboxylic acid ethyl ester Formula: C24H26N4O4 MolecularWeight: 434.48764

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C24H26N4O4/c1-5-30-21(29)24-15-23(3,4)32-20(24)18(14-26)16(13-25)12-19(24)28-22(31-6-2)27-17-10-8-7-9-11-17/h7-12,20H,5-6,15H2,1-4H3,(H,27,28)