3,3-bis[2,2-bis(4-dimethylaminophenyl)ethenyl]-5-methyl-2-benzofuran-1-one

Systemtic Name: 3,3-bis[2,2-bis(4-dimethylaminophenyl)ethenyl]-5-methyl-2-benzofuran-1-one Openeye Name: 3,3-bis[2,2-bis(4-dimethylaminophenyl)vinyl]-5-methyl-isobenzofuran-1-one CAS Name: 3,3-bis[2,2-bis(4-dimethylaminophenyl)ethenyl]-5-methyl-1-isobenzofuranone IUPAC Name: 3,3-bis[2,2-bis(4-dimethylaminophenyl)ethenyl]-5-methyl-2-benzofuran-1-one Traditional Name: 3,3-bis[2,2-bis(4-dimethylaminophenyl)vinyl]-5-methyl-phthalide Formula: C45H48N4O2 MolecularWeight: 676.88822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)OC2(C=C(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C)C=C(C5=CC=C(C=C5)N(C)C)C6=CC=C(C=C6)N(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)OC2(C=C(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C)C=C(C5=CC=C(C=C5)N(C)C)C6=CC=C(C=C6)N(C)C

InChI

InChI=1S/C45H48N4O2/c1-31-10-27-40-43(28-31)45(51-44(40)50,29-41(32-11-19-36(20-12-32)46(2)3)33-13-21-37(22-14-33)47(4)5)30-42(34-15-23-38(24-16-34)48(6)7)35-17-25-39(26-18-35)49(8)9/h10-30H,1-9H3