1-[5-(diethylamino)-2-[1-(1-octylindol-3-yl)-3-oxidanylidene-2-benzofuran-1-yl]phenoxy]ethyl prop-2-enoate

Systemtic Name: 1-[5-(diethylamino)-2-[1-(1-octylindol-3-yl)-3-oxidanylidene-2-benzofuran-1-yl]phenoxy]ethyl prop-2-enoate Openeye Name: 1-[5-(diethylamino)-2-[1-(1-octylindol-3-yl)-3-oxo-isobenzofuran-1-yl]phenoxy]ethyl prop-2-enoate CAS Name: 2-propenoic acid 1-[5-(diethylamino)-2-[1-(1-octyl-3-indolyl)-3-oxo-1-isobenzofuranyl]phenoxy]ethyl ester IUPAC Name: 1-[5-(diethylamino)-2-[1-(1-octylindol-3-yl)-3-oxo-2-benzofuran-1-yl]phenoxy]ethyl prop-2-enoate Traditional Name: acrylic acid 1-[5-(diethylamino)-2-[3-keto-1-(1-octylindol-3-yl)phthalan-1-yl]phenoxy]ethyl ester Formula: C39H46N2O5 MolecularWeight: 622.79294

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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(C=C(C=C5)N(CC)CC)OC(C)OC(=O)C=C

Isomeric SMILES

CCCCCCCCN1C=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OC(C)OC(=O)C=C

InChI

InChI=1S/C39H46N2O5/c1-6-10-11-12-13-18-25-41-27-34(30-19-15-17-22-35(30)41)39(32-21-16-14-20-31(32)38(43)46-39)33-24-23-29(40(8-3)9-4)26-36(33)44-28(5)45-37(42)7-2/h7,14-17,19-24,26-28H,2,6,8-13,18,25H2,1,3-5H3