N-(2,5-diethoxyphenyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-(2,5-diethoxyphenyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-(2,5-diethoxyphenyl)-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-(2,5-diethoxyphenyl)-4-(4-methylphenyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-(2,5-diethoxyphenyl)-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-(2,5-diethoxyphenyl)-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H25NO5/c1-4-31-19-14-15-23(32-5-2)22(16-19)28-26(29)25-24(18-12-10-17(3)11-13-18)20-8-6-7-9-21(20)27(30)33-25/h6-16H,4-5H2,1-3H3,(H,28,29)