4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one

Systemtic Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-(4-morpholinyl)ethyl]amino]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]amino]methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]methyl]-7,8-dimethyl-coumarin Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNCC(C3=CC=C(C=C3)OC)N4CCOCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=C(C=C3)OC)N4CCOCC4)C

InChI

InChI=1S/C25H30N2O4/c1-17-4-9-22-20(14-24(28)31-25(22)18(17)2)15-26-16-23(27-10-12-30-13-11-27)19-5-7-21(29-3)8-6-19/h4-9,14,23,26H,10-13,15-16H2,1-3H3/t23-/m1/s1