3-heptyl-4-methyl-7-(2-naphthalen-2-yl-2-oxidanylidene-ethoxy)chromen-2-one

Systemtic Name: 3-heptyl-4-methyl-7-(2-naphthalen-2-yl-2-oxidanylidene-ethoxy)chromen-2-one Openeye Name: 3-heptyl-4-methyl-7-[2-(2-naphthyl)-2-oxo-ethoxy]chromen-2-one CAS Name: 3-heptyl-4-methyl-7-[2-(2-naphthalenyl)-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 3-heptyl-4-methyl-7-(2-naphthalen-2-yl-2-oxoethoxy)chromen-2-one Traditional Name: 3-heptyl-7-[2-keto-2-(2-naphthyl)ethoxy]-4-methyl-coumarin Formula: C29H30O4 MolecularWeight: 442.5461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=CC4=CC=CC=C4C=C3)OC1=O)C

Isomeric SMILES

CCCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=CC4=CC=CC=C4C=C3)OC1=O)C

InChI

InChI=1S/C29H30O4/c1-3-4-5-6-7-12-26-20(2)25-16-15-24(18-28(25)33-29(26)31)32-19-27(30)23-14-13-21-10-8-9-11-22(21)17-23/h8-11,13-18H,3-7,12,19H2,1-2H3