4-(chloromethyl)-7-octanoyl-chromen-2-one

Systemtic Name: 4-(chloromethyl)-7-octanoyl-chromen-2-one Openeye Name: 4-(chloromethyl)-7-octanoyl-chromen-2-one CAS Name: 4-(chloromethyl)-7-(1-oxooctyl)-1-benzopyran-2-one IUPAC Name: 4-(chloromethyl)-7-octanoylchromen-2-one Traditional Name: 7-caprylyl-4-(chloromethyl)coumarin Formula: C18H21ClO3 MolecularWeight: 320.81054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC2=C(C=C1)C(=CC(=O)O2)CCl

Isomeric SMILES

CCCCCCCC(=O)C1=CC2=C(C=C1)C(=CC(=O)O2)CCl

InChI

InChI=1S/C18H21ClO3/c1-2-3-4-5-6-7-16(20)13-8-9-15-14(12-19)11-18(21)22-17(15)10-13/h8-11H,2-7,12H2,1H3