6-chloranyl-4-hept-1-ynyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-hept-1-ynyl-chromen-2-one Openeye Name: 6-chloro-4-hept-1-ynyl-chromen-2-one CAS Name: 6-chloro-4-hept-1-ynyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-hept-1-ynylchromen-2-one Traditional Name: 6-chloro-4-hept-1-ynyl-coumarin Formula: C16H15ClO2 MolecularWeight: 274.7421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=CC(=O)OC2=C1C=C(C=C2)Cl

Isomeric SMILES

CCCCCC#CC1=CC(=O)OC2=C1C=C(C=C2)Cl

InChI

InChI=1S/C16H15ClO2/c1-2-3-4-5-6-7-12-10-16(18)19-15-9-8-13(17)11-14(12)15/h8-11H,2-5H2,1H3