5-bromanyl-6-(ethylamino)-3-[2-methyl-4-[(2-methylphenyl)methylamino]phenyl]-3H-2-benzofuran-1-one

Systemtic Name: 5-bromanyl-6-(ethylamino)-3-[2-methyl-4-[(2-methylphenyl)methylamino]phenyl]-3H-2-benzofuran-1-one Openeye Name: 5-bromo-6-(ethylamino)-3-[2-methyl-4-(o-tolylmethylamino)phenyl]-3H-isobenzofuran-1-one CAS Name: 5-bromo-6-(ethylamino)-3-[2-methyl-4-[(2-methylphenyl)methylamino]phenyl]-3H-isobenzofuran-1-one IUPAC Name: 5-bromo-6-(ethylamino)-3-[2-methyl-4-[(2-methylphenyl)methylamino]phenyl]-3H-2-benzofuran-1-one Traditional Name: 5-bromo-6-(ethylamino)-3-[2-methyl-4-[(2-methylbenzyl)amino]phenyl]phthalide Formula: C25H25BrN2O2 MolecularWeight: 465.3822

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(OC(=O)C2=C1)C3=C(C=C(C=C3)NCC4=CC=CC=C4C)C)Br

Isomeric SMILES

CCNC1=C(C=C2C(OC(=O)C2=C1)C3=C(C=C(C=C3)NCC4=CC=CC=C4C)C)Br

InChI

InChI=1S/C25H25BrN2O2/c1-4-27-23-13-21-20(12-22(23)26)24(30-25(21)29)19-10-9-18(11-16(19)3)28-14-17-8-6-5-7-15(17)2/h5-13,24,27-28H,4,14H2,1-3H3