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

Systemtic Name: 6-chloranyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]-3-hexyl-4-methyl-chromen-2-one Openeye Name: 6-chloro-7-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethoxy]-3-hexyl-4-methyl-chromen-2-one CAS Name: 6-chloro-7-[2-(1,2-dimethyl-3-indolyl)-2-oxoethoxy]-3-hexyl-4-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-7-[2-(1,2-dimethylindol-3-yl)-2-oxoethoxy]-3-hexyl-4-methylchromen-2-one Traditional Name: 6-chloro-7-[2-(1,2-dimethylindol-3-yl)-2-keto-ethoxy]-3-hexyl-4-methyl-coumarin Formula: C28H30ClNO4 MolecularWeight: 479.9951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C)Cl)C

Isomeric SMILES

CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C)Cl)C

InChI

InChI=1S/C28H30ClNO4/c1-5-6-7-8-11-19-17(2)21-14-22(29)26(15-25(21)34-28(19)32)33-16-24(31)27-18(3)30(4)23-13-10-9-12-20(23)27/h9-10,12-15H,5-8,11,16H2,1-4H3