8-hexadecyl-5,6-dimethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 8-hexadecyl-5,6-dimethyl-7-oxidanyl-chromen-2-one Openeye Name: 8-hexadecyl-7-hydroxy-5,6-dimethyl-chromen-2-one CAS Name: 8-hexadecyl-7-hydroxy-5,6-dimethyl-1-benzopyran-2-one IUPAC Name: 8-hexadecyl-7-hydroxy-5,6-dimethylchromen-2-one Traditional Name: 8-cetyl-7-hydroxy-5,6-dimethyl-coumarin Formula: C27H42O3 MolecularWeight: 414.62058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C2C(=C(C(=C1O)C)C)C=CC(=O)O2

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C2C(=C(C(=C1O)C)C)C=CC(=O)O2

InChI

InChI=1S/C27H42O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-26(29)22(3)21(2)23-19-20-25(28)30-27(23)24/h19-20,29H,4-18H2,1-3H3