7-butoxy-6-chloranyl-4-(4-methoxyphenyl)chromen-2-one

Systemtic Name: 7-butoxy-6-chloranyl-4-(4-methoxyphenyl)chromen-2-one Openeye Name: 7-butoxy-6-chloro-4-(4-methoxyphenyl)chromen-2-one CAS Name: 7-butoxy-6-chloro-4-(4-methoxyphenyl)-1-benzopyran-2-one IUPAC Name: 7-butoxy-6-chloro-4-(4-methoxyphenyl)chromen-2-one Traditional Name: 7-butoxy-6-chloro-4-(4-methoxyphenyl)coumarin Formula: C20H19ClO4 MolecularWeight: 358.81546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CCCCOC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C20H19ClO4/c1-3-4-9-24-19-12-18-16(10-17(19)21)15(11-20(22)25-18)13-5-7-14(23-2)8-6-13/h5-8,10-12H,3-4,9H2,1-2H3