3-[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]chromen-2-one

Systemtic Name: 3-[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]chromen-2-one Openeye Name: 3-[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-enoyl]chromen-2-one CAS Name: 3-[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]-1-benzopyran-2-one IUPAC Name: 3-[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]chromen-2-one Traditional Name: 3-[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)acryloyl]coumarin Formula: C22H19ClO5 MolecularWeight: 398.83626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=CC(=O)C2=CC3=CC=CC=C3OC2=O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C/C(=O)C2=CC3=CC=CC=C3OC2=O)OC

InChI

InChI=1S/C22H19ClO5/c1-13(2)27-21-17(23)10-14(11-20(21)26-3)8-9-18(24)16-12-15-6-4-5-7-19(15)28-22(16)25/h4-13H,1-3H3/b9-8+