4-[[[(2S)-2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[[(2S)-2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[[(2S)-2-(4-fluorophenyl)-2-morpholino-ethyl]amino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[[(2S)-2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]amino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]amino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[[(2S)-2-(4-fluorophenyl)-2-morpholino-ethyl]amino]methyl]-7-methoxy-coumarin Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CNCC(C3=CC=C(C=C3)F)N4CCOCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=C(C=C3)F)N4CCOCC4

InChI

InChI=1S/C23H25FN2O4/c1-28-19-6-7-20-17(12-23(27)30-22(20)13-19)14-25-15-21(26-8-10-29-11-9-26)16-2-4-18(24)5-3-16/h2-7,12-13,21,25H,8-11,14-15H2,1H3/t21-/m1/s1