(3E)-2-methyl-6-oxidanyl-3-phenethylidene-7-propyl-isoindol-1-one

Systemtic Name: (3E)-2-methyl-6-oxidanyl-3-phenethylidene-7-propyl-isoindol-1-one Openeye Name: (3E)-6-hydroxy-2-methyl-3-phenethylidene-7-propyl-isoindolin-1-one CAS Name: (3E)-6-hydroxy-2-methyl-3-phenethylidene-7-propyl-1-isoindolone IUPAC Name: (3E)-6-hydroxy-2-methyl-3-phenethylidene-7-propylisoindol-1-one Traditional Name: (3E)-6-hydroxy-2-methyl-3-phenethylidene-7-propyl-isoindolin-1-one Formula: C20H21NO2 MolecularWeight: 307.38624

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1C(=O)N(C2=CCC3=CC=CC=C3)C)O

Isomeric SMILES

CCCC1=C(C=CC\2=C1C(=O)N(/C2=C/CC3=CC=CC=C3)C)O

InChI

InChI=1S/C20H21NO2/c1-3-7-16-18(22)13-11-15-17(21(2)20(23)19(15)16)12-10-14-8-5-4-6-9-14/h4-6,8-9,11-13,22H,3,7,10H2,1-2H3/b17-12+