4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]-8-methyl-chromen-2-one

Systemtic Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]-8-methyl-chromen-2-one Openeye Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethoxy]-8-methyl-chromen-2-one CAS Name: 4-butyl-7-[2-(1,2-dimethyl-3-indolyl)-2-oxoethoxy]-8-methyl-1-benzopyran-2-one IUPAC Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxoethoxy]-8-methylchromen-2-one Traditional Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-keto-ethoxy]-8-methyl-coumarin Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C

InChI

InChI=1S/C26H27NO4/c1-5-6-9-18-14-24(29)31-26-16(2)23(13-12-19(18)26)30-15-22(28)25-17(3)27(4)21-11-8-7-10-20(21)25/h7-8,10-14H,5-6,9,15H2,1-4H3