6-azanyl-5-chloranyl-3-(2-methyl-1-octyl-indol-3-yl)-3H-2-benzofuran-1-one

Systemtic Name: 6-azanyl-5-chloranyl-3-(2-methyl-1-octyl-indol-3-yl)-3H-2-benzofuran-1-one Openeye Name: 6-amino-5-chloro-3-(2-methyl-1-octyl-indol-3-yl)-3H-isobenzofuran-1-one CAS Name: 6-amino-5-chloro-3-(2-methyl-1-octyl-3-indolyl)-3H-isobenzofuran-1-one IUPAC Name: 6-amino-5-chloro-3-(2-methyl-1-octylindol-3-yl)-3H-2-benzofuran-1-one Traditional Name: 6-amino-5-chloro-3-(2-methyl-1-octyl-indol-3-yl)phthalide Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3C4=CC(=C(C=C4C(=O)O3)N)Cl)C

Isomeric SMILES

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3C4=CC(=C(C=C4C(=O)O3)N)Cl)C

InChI

InChI=1S/C25H29ClN2O2/c1-3-4-5-6-7-10-13-28-16(2)23(17-11-8-9-12-22(17)28)24-18-14-20(26)21(27)15-19(18)25(29)30-24/h8-9,11-12,14-15,24H,3-7,10,13,27H2,1-2H3