3-[(E)-3-(4-bromophenyl)prop-2-enoyl]-7-(diethylamino)chromen-2-one

Systemtic Name: 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]-7-(diethylamino)chromen-2-one Openeye Name: 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]-7-(diethylamino)chromen-2-one CAS Name: 3-[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]-7-(diethylamino)-1-benzopyran-2-one IUPAC Name: 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]-7-(diethylamino)chromen-2-one Traditional Name: 3-[(E)-3-(4-bromophenyl)acryloyl]-7-(diethylamino)coumarin Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrNO3/c1-3-24(4-2)18-11-8-16-13-19(22(26)27-21(16)14-18)20(25)12-7-15-5-9-17(23)10-6-15/h5-14H,3-4H2,1-2H3/b12-7+