3-chloranyl-4-methyl-7-[(4-methylphenyl)methoxy]chromen-2-one

Systemtic Name: 3-chloranyl-4-methyl-7-[(4-methylphenyl)methoxy]chromen-2-one Openeye Name: 3-chloro-4-methyl-7-(p-tolylmethoxy)chromen-2-one CAS Name: 3-chloro-4-methyl-7-[(4-methylphenyl)methoxy]-1-benzopyran-2-one IUPAC Name: 3-chloro-4-methyl-7-[(4-methylphenyl)methoxy]chromen-2-one Traditional Name: 3-chloro-4-methyl-7-(4-methylbenzyl)oxy-coumarin Formula: C18H15ClO3 MolecularWeight: 314.7629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=C(C(=O)O3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=C(C(=O)O3)Cl)C

InChI

InChI=1S/C18H15ClO3/c1-11-3-5-13(6-4-11)10-21-14-7-8-15-12(2)17(19)18(20)22-16(15)9-14/h3-9H,10H2,1-2H3