2-(4-methoxyphenyl)carbonyl-4-phenylmethoxy-3a,4,5,6,7,7a-hexahydro-3H-isoindol-1-one

Systemtic Name: 2-(4-methoxyphenyl)carbonyl-4-phenylmethoxy-3a,4,5,6,7,7a-hexahydro-3H-isoindol-1-one Openeye Name: 4-benzyloxy-2-(4-methoxybenzoyl)-3a,4,5,6,7,7a-hexahydro-3H-isoindol-1-one CAS Name: 2-[(4-methoxyphenyl)-oxomethyl]-4-phenylmethoxy-3a,4,5,6,7,7a-hexahydro-3H-isoindol-1-one IUPAC Name: 2-(4-methoxybenzoyl)-4-phenylmethoxy-3a,4,5,6,7,7a-hexahydro-3H-isoindol-1-one Traditional Name: 4-benzoxy-2-p-anisoyl-3a,4,5,6,7,7a-hexahydro-3H-isoindol-1-one Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CC3C(C2=O)CCCC3OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CC3C(C2=O)CCCC3OCC4=CC=CC=C4

InChI

InChI=1S/C23H25NO4/c1-27-18-12-10-17(11-13-18)22(25)24-14-20-19(23(24)26)8-5-9-21(20)28-15-16-6-3-2-4-7-16/h2-4,6-7,10-13,19-21H,5,8-9,14-15H2,1H3