3-[(4-chlorophenyl)methyl]-5-methoxy-7-methyl-chromen-2-one

Systemtic Name: 3-[(4-chlorophenyl)methyl]-5-methoxy-7-methyl-chromen-2-one Openeye Name: 3-[(4-chlorophenyl)methyl]-5-methoxy-7-methyl-chromen-2-one CAS Name: 3-[(4-chlorophenyl)methyl]-5-methoxy-7-methyl-1-benzopyran-2-one IUPAC Name: 3-[(4-chlorophenyl)methyl]-5-methoxy-7-methylchromen-2-one Traditional Name: 3-(4-chlorobenzyl)-5-methoxy-7-methyl-coumarin Formula: C18H15ClO3 MolecularWeight: 314.7629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C(C(=O)O2)CC3=CC=C(C=C3)Cl)C(=C1)OC

Isomeric SMILES

CC1=CC2=C(C=C(C(=O)O2)CC3=CC=C(C=C3)Cl)C(=C1)OC

InChI

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