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

Systemtic Name: 7-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]-3-hexyl-4-methyl-chromen-2-one Openeye Name: 7-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethoxy]-3-hexyl-4-methyl-chromen-2-one CAS Name: 7-[2-(1,2-dimethyl-3-indolyl)-2-oxoethoxy]-3-hexyl-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[2-(1,2-dimethylindol-3-yl)-2-oxoethoxy]-3-hexyl-4-methylchromen-2-one Traditional Name: 7-[2-(1,2-dimethylindol-3-yl)-2-keto-ethoxy]-3-hexyl-4-methyl-coumarin Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C)OC1=O)C

InChI

InChI=1S/C28H31NO4/c1-5-6-7-8-11-22-18(2)21-15-14-20(16-26(21)33-28(22)31)32-17-25(30)27-19(3)29(4)24-13-10-9-12-23(24)27/h9-10,12-16H,5-8,11,17H2,1-4H3