2-[1-(3,4-dipropylphenyl)-3-oxidanyl-propyl]-3H-isoindol-1-one

Systemtic Name: 2-[1-(3,4-dipropylphenyl)-3-oxidanyl-propyl]-3H-isoindol-1-one Openeye Name: 2-[1-(3,4-dipropylphenyl)-3-hydroxy-propyl]isoindolin-1-one CAS Name: 2-[1-(3,4-dipropylphenyl)-3-hydroxypropyl]-3H-isoindol-1-one IUPAC Name: 2-[1-(3,4-dipropylphenyl)-3-hydroxypropyl]-3H-isoindol-1-one Traditional Name: 2-[1-(3,4-dipropylphenyl)-3-hydroxy-propyl]isoindolin-1-one Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C(CCO)N2CC3=CC=CC=C3C2=O)CCC

Isomeric SMILES

CCCC1=C(C=C(C=C1)C(CCO)N2CC3=CC=CC=C3C2=O)CCC

InChI

InChI=1S/C23H29NO2/c1-3-7-17-11-12-19(15-18(17)8-4-2)22(13-14-25)24-16-20-9-5-6-10-21(20)23(24)26/h5-6,9-12,15,22,25H,3-4,7-8,13-14,16H2,1-2H3