3-(1-butyl-2-methyl-indol-3-yl)-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-(1-butyl-2-methyl-indol-3-yl)-3-(2-methyl-1-octyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-(1-butyl-2-methyl-indol-3-yl)-3-(2-methyl-1-octyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-(1-butyl-2-methyl-3-indolyl)-3-(2-methyl-1-octyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-(1-butyl-2-methylindol-3-yl)-3-(2-methyl-1-octylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-(1-butyl-2-methyl-indol-3-yl)-3-(2-methyl-1-octyl-indol-3-yl)phthalide Formula: C38H44N2O2 MolecularWeight: 560.76816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CCCC)C)C

Isomeric SMILES

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CCCC)C)C

InChI

InChI=1S/C38H44N2O2/c1-5-7-9-10-11-18-26-40-28(4)36(31-21-14-17-24-34(31)40)38(32-22-15-12-19-29(32)37(41)42-38)35-27(3)39(25-8-6-2)33-23-16-13-20-30(33)35/h12-17,19-24H,5-11,18,25-26H2,1-4H3