6-chloranyl-4-methyl-7-(3-methylbut-2-enoxy)-3-(phenylmethyl)chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-(3-methylbut-2-enoxy)-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-6-chloro-4-methyl-7-(3-methylbut-2-enoxy)chromen-2-one CAS Name: 6-chloro-4-methyl-7-(3-methylbut-2-enoxy)-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-6-chloro-4-methyl-7-(3-methylbut-2-enoxy)chromen-2-one Traditional Name: 3-benzyl-6-chloro-4-methyl-7-(3-methylbut-2-enoxy)coumarin Formula: C22H21ClO3 MolecularWeight: 368.85334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC=C(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC=C(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C22H21ClO3/c1-14(2)9-10-25-21-13-20-17(12-19(21)23)15(3)18(22(24)26-20)11-16-7-5-4-6-8-16/h4-9,12-13H,10-11H2,1-3H3