7,8-dimethyl-4-[[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]methyl]chromen-2-one

Systemtic Name: 7,8-dimethyl-4-[[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]methyl]chromen-2-one Openeye Name: 4-[[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[[(2S)-2-hydroxy-2-phenylethyl]amino]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-hydroxy-2-phenylethyl]amino]methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]methyl]-7,8-dimethyl-coumarin Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO3/c1-13-8-9-17-16(10-19(23)24-20(17)14(13)2)11-21-12-18(22)15-6-4-3-5-7-15/h3-10,18,21-22H,11-12H2,1-2H3/t18-/m1/s1