N-(3-methylbutyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-isopentyl-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-(3-methylbutyl)-4-(4-methylphenyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-(3-methylbutyl)-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-isoamyl-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCC(C)C

InChI

InChI=1S/C22H23NO3/c1-14(2)12-13-23-21(24)20-19(16-10-8-15(3)9-11-16)17-6-4-5-7-18(17)22(25)26-20/h4-11,14H,12-13H2,1-3H3,(H,23,24)