N-(2-ethylhexyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-(2-ethylhexyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-(2-ethylhexyl)-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-(2-ethylhexyl)-4-(4-methylphenyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-(2-ethylhexyl)-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-(2-ethylhexyl)-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(C2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(C2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H29NO3/c1-4-6-9-18(5-2)16-26-24(27)23-22(19-14-12-17(3)13-15-19)20-10-7-8-11-21(20)25(28)29-23/h7-8,10-15,18H,4-6,9,16H2,1-3H3,(H,26,27)