(3E)-3-[[2-azanyl-5-(2-dimethylaminoethyloxy)phenyl]methylidene]-7-methoxy-2-benzofuran-1-one

Systemtic Name: (3E)-3-[[2-azanyl-5-(2-dimethylaminoethyloxy)phenyl]methylidene]-7-methoxy-2-benzofuran-1-one Openeye Name: (3E)-3-[[2-amino-5-(2-dimethylaminoethyloxy)phenyl]methylene]-7-methoxy-isobenzofuran-1-one CAS Name: (3E)-3-[[2-amino-5-(2-dimethylaminoethyloxy)phenyl]methylidene]-7-methoxy-1-isobenzofuranone IUPAC Name: (3E)-3-[[2-amino-5-(2-dimethylaminoethyloxy)phenyl]methylidene]-7-methoxy-2-benzofuran-1-one Traditional Name: (3E)-3-[2-amino-5-(2-dimethylaminoethyloxy)benzylidene]-7-methoxy-phthalide Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC(=C(C=C1)N)C=C2C3=C(C(=CC=C3)OC)C(=O)O2

Isomeric SMILES

CN(C)CCOC1=CC(=C(C=C1)N)/C=C/2\C3=C(C(=CC=C3)OC)C(=O)O2

InChI

InChI=1S/C20H22N2O4/c1-22(2)9-10-25-14-7-8-16(21)13(11-14)12-18-15-5-4-6-17(24-3)19(15)20(23)26-18/h4-8,11-12H,9-10,21H2,1-3H3/b18-12+