4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]amino]methyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]amino]methyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]methyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-(4-morpholinyl)ethyl]amino]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]amino]methyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[[(2S)-2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]methyl]-6,7-dimethyl-coumarin Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCC(C3=CC=C(C=C3)OC)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=C(C=C3)OC)N4CCOCC4)C

InChI

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