(E)-1-morpholin-4-yl-3-[4-(6-oxidanyl-2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-morpholin-4-yl-3-[4-(6-oxidanyl-2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-[4-(6-hydroxy-2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]-1-morpholino-prop-2-en-1-one CAS Name: (E)-3-[4-(6-hydroxy-2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]-1-(4-morpholinyl)-2-propen-1-one IUPAC Name: (E)-3-[4-(6-hydroxy-2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]-1-morpholin-4-ylprop-2-en-1-one Traditional Name: (E)-3-[4-(6-hydroxy-2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]-1-morpholino-prop-2-en-1-one Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=C1C=C(C=C2)O)C3=CC=C(C=C3)C=CC(=O)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

C1CN(C(C2=C1C=C(C=C2)O)C3=CC=C(C=C3)/C=C/C(=O)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N2O3/c31-25-11-12-26-23(20-25)14-15-30(24-4-2-1-3-5-24)28(26)22-9-6-21(7-10-22)8-13-27(32)29-16-18-33-19-17-29/h1-13,20,28,31H,14-19H2/b13-8+