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

Systemtic Name: 4-butyl-6-chloranyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]chromen-2-one Openeye Name: 4-butyl-6-chloro-7-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethoxy]chromen-2-one CAS Name: 4-butyl-6-chloro-7-[2-(1,2-dimethyl-3-indolyl)-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 4-butyl-6-chloro-7-[2-(1,2-dimethylindol-3-yl)-2-oxoethoxy]chromen-2-one Traditional Name: 4-butyl-6-chloro-7-[2-(1,2-dimethylindol-3-yl)-2-keto-ethoxy]coumarin Formula: C25H24ClNO4 MolecularWeight: 437.91536

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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=CC=CC=C43)C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C

InChI

InChI=1S/C25H24ClNO4/c1-4-5-8-16-11-24(29)31-22-13-23(19(26)12-18(16)22)30-14-21(28)25-15(2)27(3)20-10-7-6-9-17(20)25/h6-7,9-13H,4-5,8,14H2,1-3H3