2-[1-(3-ethoxy-4-methoxy-phenyl)-3-phenylmethoxy-propyl]isoindole-1,3-dione

Systemtic Name: 2-[1-(3-ethoxy-4-methoxy-phenyl)-3-phenylmethoxy-propyl]isoindole-1,3-dione Openeye Name: 2-[3-benzyloxy-1-(3-ethoxy-4-methoxy-phenyl)propyl]isoindoline-1,3-dione CAS Name: 2-[1-(3-ethoxy-4-methoxyphenyl)-3-phenylmethoxypropyl]isoindole-1,3-dione IUPAC Name: 2-[1-(3-ethoxy-4-methoxyphenyl)-3-phenylmethoxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-benzoxy-1-(3-ethoxy-4-methoxy-phenyl)propyl]isoindoline-1,3-quinone Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CCOCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CCOCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C27H27NO5/c1-3-33-25-17-20(13-14-24(25)31-2)23(15-16-32-18-19-9-5-4-6-10-19)28-26(29)21-11-7-8-12-22(21)27(28)30/h4-14,17,23H,3,15-16,18H2,1-2H3