3-(1-butyl-2-methyl-indol-3-yl)-3-methoxy-2-benzofuran-1-one

Systemtic Name: 3-(1-butyl-2-methyl-indol-3-yl)-3-methoxy-2-benzofuran-1-one Openeye Name: 3-(1-butyl-2-methyl-indol-3-yl)-3-methoxy-isobenzofuran-1-one CAS Name: 3-(1-butyl-2-methyl-3-indolyl)-3-methoxy-1-isobenzofuranone IUPAC Name: 3-(1-butyl-2-methylindol-3-yl)-3-methoxy-2-benzofuran-1-one Traditional Name: 3-(1-butyl-2-methyl-indol-3-yl)-3-methoxy-phthalide Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)OC)C

Isomeric SMILES

CCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)OC)C

InChI

InChI=1S/C22H23NO3/c1-4-5-14-23-15(2)20(17-11-7-9-13-19(17)23)22(25-3)18-12-8-6-10-16(18)21(24)26-22/h6-13H,4-5,14H2,1-3H3