3-(aminomethyl)-6-ethyl-5,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-(aminomethyl)-6-ethyl-5,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-(aminomethyl)-6-ethyl-5,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-(aminomethyl)-6-ethyl-5,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(aminomethyl)-6-ethyl-5,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(aminomethyl)-6-ethyl-5,7-dimethoxy-phthalide Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(OC(=O)C2=C1OC)CN)OC

Isomeric SMILES

CCC1=C(C=C2C(OC(=O)C2=C1OC)CN)OC

InChI

InChI=1S/C13H17NO4/c1-4-7-9(16-2)5-8-10(6-14)18-13(15)11(8)12(7)17-3/h5,10H,4,6,14H2,1-3H3