2-[(1S)-1-(4-methoxy-3-phenylmethoxy-phenyl)-3-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 2-[(1S)-1-(4-methoxy-3-phenylmethoxy-phenyl)-3-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[(1S)-1-(3-benzyloxy-4-methoxy-phenyl)-3-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[(1S)-1-(4-methoxy-3-phenylmethoxyphenyl)-3-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[(1S)-1-(4-methoxy-3-phenylmethoxyphenyl)-3-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[(1S)-1-(3-benzoxy-4-methoxy-phenyl)-3-keto-butyl]isoindoline-1,3-quinone Formula: C26H23NO5 MolecularWeight: 429.46452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC(=C(C=C1)OC)OCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)C[C@@H](C1=CC(=C(C=C1)OC)OCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H23NO5/c1-17(28)14-22(27-25(29)20-10-6-7-11-21(20)26(27)30)19-12-13-23(31-2)24(15-19)32-16-18-8-4-3-5-9-18/h3-13,15,22H,14,16H2,1-2H3/t22-/m0/s1