4-butyl-6-chloranyl-7-[2-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-oxidanylidene-ethoxy]chromen-2-one

Systemtic Name: 4-butyl-6-chloranyl-7-[2-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-oxidanylidene-ethoxy]chromen-2-one Openeye Name: 4-butyl-6-chloro-7-[2-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-oxo-ethoxy]chromen-2-one CAS Name: 4-butyl-6-chloro-7-[2-(5-methoxy-1,2-dimethyl-3-indolyl)-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 4-butyl-6-chloro-7-[2-(5-methoxy-1,2-dimethylindol-3-yl)-2-oxoethoxy]chromen-2-one Traditional Name: 4-butyl-6-chloro-7-[2-keto-2-(5-methoxy-1,2-dimethyl-indol-3-yl)ethoxy]coumarin Formula: C26H26ClNO5 MolecularWeight: 467.94134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=C(N(C4=C3C=C(C=C4)OC)C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=C(N(C4=C3C=C(C=C4)OC)C)C

InChI

InChI=1S/C26H26ClNO5/c1-5-6-7-16-10-25(30)33-23-13-24(20(27)12-18(16)23)32-14-22(29)26-15(2)28(3)21-9-8-17(31-4)11-19(21)26/h8-13H,5-7,14H2,1-4H3