3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-hexyl-2-methyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-hexyl-2-methyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-hexyl-2-methyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-ethoxyphenyl]-3-(1-hexyl-2-methyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)-2-ethoxyphenyl]-3-(1-hexyl-2-methylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-hexyl-2-methyl-indol-3-yl)phthalide Formula: C35H42N2O3 MolecularWeight: 538.71958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C

Isomeric SMILES

CCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C

InChI

InChI=1S/C35H42N2O3/c1-6-10-11-16-23-37-25(5)33(28-18-13-15-20-31(28)37)35(29-19-14-12-17-27(29)34(38)40-35)30-22-21-26(36(7-2)8-3)24-32(30)39-9-4/h12-15,17-22,24H,6-11,16,23H2,1-5H3