3-[4-[bis(prop-2-ynyl)amino]-2-methyl-phenyl]-6-(dimethylamino)-3H-2-benzofuran-1-one

Systemtic Name: 3-[4-[bis(prop-2-ynyl)amino]-2-methyl-phenyl]-6-(dimethylamino)-3H-2-benzofuran-1-one Openeye Name: 3-[4-[bis(prop-2-ynyl)amino]-2-methyl-phenyl]-6-(dimethylamino)-3H-isobenzofuran-1-one CAS Name: 3-[4-[bis(prop-2-ynyl)amino]-2-methylphenyl]-6-(dimethylamino)-3H-isobenzofuran-1-one IUPAC Name: 3-[4-[bis(prop-2-ynyl)amino]-2-methylphenyl]-6-(dimethylamino)-3H-2-benzofuran-1-one Traditional Name: 6-(dimethylamino)-3-[4-(dipropargylamino)-2-methyl-phenyl]phthalide Formula: C23H22N2O2 MolecularWeight: 358.43298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CC#C)CC#C)C2C3=C(C=C(C=C3)N(C)C)C(=O)O2

Isomeric SMILES

CC1=C(C=CC(=C1)N(CC#C)CC#C)C2C3=C(C=C(C=C3)N(C)C)C(=O)O2

InChI

InChI=1S/C23H22N2O2/c1-6-12-25(13-7-2)18-9-10-19(16(3)14-18)22-20-11-8-17(24(4)5)15-21(20)23(26)27-22/h1-2,8-11,14-15,22H,12-13H2,3-5H3