5-(methoxymethoxy)-2-methyl-3-oxidanyl-3-phenethyl-6-propyl-isoindol-1-one

Systemtic Name: 5-(methoxymethoxy)-2-methyl-3-oxidanyl-3-phenethyl-6-propyl-isoindol-1-one Openeye Name: 3-hydroxy-5-(methoxymethoxy)-2-methyl-3-phenethyl-6-propyl-isoindolin-1-one CAS Name: 3-hydroxy-5-(methoxymethoxy)-2-methyl-3-phenethyl-6-propyl-1-isoindolone IUPAC Name: 3-hydroxy-5-(methoxymethoxy)-2-methyl-3-phenethyl-6-propylisoindol-1-one Traditional Name: 3-hydroxy-5-(methoxymethoxy)-2-methyl-3-phenethyl-6-propyl-isoindolin-1-one Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)N(C2(CCC3=CC=CC=C3)O)C)OCOC

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)N(C2(CCC3=CC=CC=C3)O)C)OCOC

InChI

InChI=1S/C22H27NO4/c1-4-8-17-13-18-19(14-20(17)27-15-26-3)22(25,23(2)21(18)24)12-11-16-9-6-5-7-10-16/h5-7,9-10,13-14,25H,4,8,11-12,15H2,1-3H3