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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(N(C5=CC=CC=C54)CC)C)OCC

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(N(C5=CC=CC=C54)CC)C)OCC

InChI

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