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

Systemtic Name: 3-[2-decoxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-[2-decoxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)isobenzofuran-1-one CAS Name: 3-[2-decoxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methyl-3-indolyl)-1-isobenzofuranone IUPAC Name: 3-[2-decoxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methylindol-3-yl)-2-benzofuran-1-one Traditional Name: 3-[2-decoxy-4-(diethylamino)phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)phthalide Formula: C39H50N2O3 MolecularWeight: 594.8259

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=CC(=C1)N(CC)CC)C2(C3=CC=CC=C3C(=O)O2)C4=C(N(C5=CC=CC=C54)CC)C

Isomeric SMILES

CCCCCCCCCCOC1=C(C=CC(=C1)N(CC)CC)C2(C3=CC=CC=C3C(=O)O2)C4=C(N(C5=CC=CC=C54)CC)C

InChI

InChI=1S/C39H50N2O3/c1-6-10-11-12-13-14-15-20-27-43-36-28-30(40(7-2)8-3)25-26-34(36)39(33-23-18-16-21-31(33)38(42)44-39)37-29(5)41(9-4)35-24-19-17-22-32(35)37/h16-19,21-26,28H,6-15,20,27H2,1-5H3