5-methoxy-3-oxidanyl-2-(3-phenylpropyl)-3H-isoindol-1-one

Systemtic Name: 5-methoxy-3-oxidanyl-2-(3-phenylpropyl)-3H-isoindol-1-one Openeye Name: 3-hydroxy-5-methoxy-2-(3-phenylpropyl)isoindolin-1-one CAS Name: 3-hydroxy-5-methoxy-2-(3-phenylpropyl)-3H-isoindol-1-one IUPAC Name: 3-hydroxy-5-methoxy-2-(3-phenylpropyl)-3H-isoindol-1-one Traditional Name: 3-hydroxy-5-methoxy-2-(3-phenylpropyl)isoindolin-1-one Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C2O)CCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C2O)CCCC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3/c1-22-14-9-10-15-16(12-14)18(21)19(17(15)20)11-5-8-13-6-3-2-4-7-13/h2-4,6-7,9-10,12,18,21H,5,8,11H2,1H3