5-chloranyl-3-[4-(diethylamino)-2-methoxy-phenyl]-6-(dimethylamino)-3H-2-benzofuran-1-one

Systemtic Name: 5-chloranyl-3-[4-(diethylamino)-2-methoxy-phenyl]-6-(dimethylamino)-3H-2-benzofuran-1-one Openeye Name: 5-chloro-3-[4-(diethylamino)-2-methoxy-phenyl]-6-(dimethylamino)-3H-isobenzofuran-1-one CAS Name: 5-chloro-3-[4-(diethylamino)-2-methoxyphenyl]-6-(dimethylamino)-3H-isobenzofuran-1-one IUPAC Name: 5-chloro-3-[4-(diethylamino)-2-methoxyphenyl]-6-(dimethylamino)-3H-2-benzofuran-1-one Traditional Name: 5-chloro-3-[4-(diethylamino)-2-methoxy-phenyl]-6-(dimethylamino)phthalide Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C2C3=CC(=C(C=C3C(=O)O2)N(C)C)Cl)OC

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C2C3=CC(=C(C=C3C(=O)O2)N(C)C)Cl)OC

InChI

InChI=1S/C21H25ClN2O3/c1-6-24(7-2)13-8-9-14(19(10-13)26-5)20-15-11-17(22)18(23(3)4)12-16(15)21(25)27-20/h8-12,20H,6-7H2,1-5H3