N-butyl-4-(4-methylphenyl)-1-oxidanylidene-N-(phenylmethyl)isochromene-3-carboxamide

Systemtic Name: N-butyl-4-(4-methylphenyl)-1-oxidanylidene-N-(phenylmethyl)isochromene-3-carboxamide Openeye Name: N-benzyl-N-butyl-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-butyl-4-(4-methylphenyl)-1-oxo-N-(phenylmethyl)-2-benzopyran-3-carboxamide IUPAC Name: N-benzyl-N-butyl-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-benzyl-N-butyl-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H27NO3/c1-3-4-18-29(19-21-10-6-5-7-11-21)27(30)26-25(22-16-14-20(2)15-17-22)23-12-8-9-13-24(23)28(31)32-26/h5-17H,3-4,18-19H2,1-2H3