5-[(2,4-dimethoxyphenyl)methylamino]-3H-2-benzofuran-1-one

Systemtic Name: 5-[(2,4-dimethoxyphenyl)methylamino]-3H-2-benzofuran-1-one Openeye Name: 5-[(2,4-dimethoxyphenyl)methylamino]-3H-isobenzofuran-1-one CAS Name: 5-[(2,4-dimethoxyphenyl)methylamino]-3H-isobenzofuran-1-one IUPAC Name: 5-[(2,4-dimethoxyphenyl)methylamino]-3H-2-benzofuran-1-one Traditional Name: 5-[(2,4-dimethoxybenzyl)amino]phthalide Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=CC3=C(C=C2)C(=O)OC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=CC3=C(C=C2)C(=O)OC3)OC

InChI

InChI=1S/C17H17NO4/c1-20-14-5-3-11(16(8-14)21-2)9-18-13-4-6-15-12(7-13)10-22-17(15)19/h3-8,18H,9-10H2,1-2H3