3-[2,2-bis(1-ethyl-2-methyl-indol-3-yl)ethenyl]-3-[4-(diethylamino)-2-ethoxy-phenyl]-2-benzofuran-1-one

Systemtic Name: 3-[2,2-bis(1-ethyl-2-methyl-indol-3-yl)ethenyl]-3-[4-(diethylamino)-2-ethoxy-phenyl]-2-benzofuran-1-one Openeye Name: 3-[2,2-bis(1-ethyl-2-methyl-indol-3-yl)vinyl]-3-[4-(diethylamino)-2-ethoxy-phenyl]isobenzofuran-1-one CAS Name: 3-[2,2-bis(1-ethyl-2-methyl-3-indolyl)ethenyl]-3-[4-(diethylamino)-2-ethoxyphenyl]-1-isobenzofuranone IUPAC Name: 3-[2,2-bis(1-ethyl-2-methylindol-3-yl)ethenyl]-3-[4-(diethylamino)-2-ethoxyphenyl]-2-benzofuran-1-one Traditional Name: 3-[2,2-bis(1-ethyl-2-methyl-indol-3-yl)vinyl]-3-[4-(diethylamino)-2-ethoxy-phenyl]phthalide Formula: C44H47N3O3 MolecularWeight: 665.86228

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C(=CC3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C6=C(N(C7=CC=CC=C76)CC)C)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C(=CC3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C6=C(N(C7=CC=CC=C76)CC)C)C

InChI

InChI=1S/C44H47N3O3/c1-8-45(9-2)31-25-26-37(40(27-31)49-12-5)44(36-22-16-13-19-32(36)43(48)50-44)28-35(41-29(6)46(10-3)38-23-17-14-20-33(38)41)42-30(7)47(11-4)39-24-18-15-21-34(39)42/h13-28H,8-12H2,1-7H3