7-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]-4-phenyl-6-propyl-chromen-2-one

Systemtic Name: 7-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]-4-phenyl-6-propyl-chromen-2-one Openeye Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-phenyl-6-propyl-chromen-2-one CAS Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-phenyl-6-propyl-1-benzopyran-2-one IUPAC Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-phenyl-6-propylchromen-2-one Traditional Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-phenyl-6-propyl-coumarin Formula: C26H21ClO5 MolecularWeight: 448.89494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OCC4=CC5=C(C=C4Cl)OCO5

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OCC4=CC5=C(C=C4Cl)OCO5

InChI

InChI=1S/C26H21ClO5/c1-2-6-17-9-20-19(16-7-4-3-5-8-16)11-26(28)32-23(20)13-22(17)29-14-18-10-24-25(12-21(18)27)31-15-30-24/h3-5,7-13H,2,6,14-15H2,1H3