N-(2-cyano-4-oxidanylidene-chromen-8-yl)-2-(3-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carboxamide

Systemtic Name: N-(2-cyano-4-oxidanylidene-chromen-8-yl)-2-(3-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carboxamide Openeye Name: N-(2-cyano-4-oxo-chromen-8-yl)-2-(3-phenylpropyl)-2,3-dihydrobenzofuran-5-carboxamide CAS Name: N-(2-cyano-4-oxo-1-benzopyran-8-yl)-2-(3-phenylpropyl)-2,3-dihydrobenzofuran-5-carboxamide IUPAC Name: N-(2-cyano-4-oxochromen-8-yl)-2-(3-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carboxamide Traditional Name: N-(2-cyano-4-keto-chromen-8-yl)-2-(3-phenylpropyl)coumaran-5-carboxamide Formula: C28H22N2O4 MolecularWeight: 450.48528

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C(=O)NC3=CC=CC4=C3OC(=CC4=O)C#N)CCCC5=CC=CC=C5

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)C(=O)NC3=CC=CC4=C3OC(=CC4=O)C#N)CCCC5=CC=CC=C5

InChI

InChI=1S/C28H22N2O4/c29-17-22-16-25(31)23-10-5-11-24(27(23)34-22)30-28(32)19-12-13-26-20(14-19)15-21(33-26)9-4-8-18-6-2-1-3-7-18/h1-3,5-7,10-14,16,21H,4,8-9,15H2,(H,30,32)