2-[(4-butoxy-3-methoxy-phenyl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-butoxy-3-methoxy-phenyl)methyl]isoindole-1,3-dione Openeye Name: 2-[(4-butoxy-3-methoxy-phenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[(4-butoxy-3-methoxyphenyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-butoxy-3-methoxyphenyl)methyl]isoindole-1,3-dione Traditional Name: 2-(4-butoxy-3-methoxy-benzyl)isoindoline-1,3-quinone Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C20H21NO4/c1-3-4-11-25-17-10-9-14(12-18(17)24-2)13-21-19(22)15-7-5-6-8-16(15)20(21)23/h5-10,12H,3-4,11,13H2,1-2H3