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

Systemtic Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]chromen-2-one Openeye Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethoxy]chromen-2-one CAS Name: 4-butyl-7-[2-(1,2-dimethyl-3-indolyl)-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-oxoethoxy]chromen-2-one Traditional Name: 4-butyl-7-[2-(1,2-dimethylindol-3-yl)-2-keto-ethoxy]coumarin Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)C3=C(N(C4=CC=CC=C43)C)C

InChI

InChI=1S/C25H25NO4/c1-4-5-8-17-13-24(28)30-23-14-18(11-12-19(17)23)29-15-22(27)25-16(2)26(3)21-10-7-6-9-20(21)25/h6-7,9-14H,4-5,8,15H2,1-3H3