7-methyl-4-[[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]methyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]methyl]-6-propan-2-yl-chromen-2-one Openeye Name: 4-[[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]methyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[[(2S)-2-hydroxy-2-phenylethyl]amino]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-hydroxy-2-phenylethyl]amino]methyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]methyl]-6-isopropyl-7-methyl-coumarin Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNCC(C3=CC=CC=C3)O)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC[C@H](C3=CC=CC=C3)O)C(C)C

InChI

InChI=1S/C22H25NO3/c1-14(2)18-11-19-17(10-22(25)26-21(19)9-15(18)3)12-23-13-20(24)16-7-5-4-6-8-16/h4-11,14,20,23-24H,12-13H2,1-3H3/t20-/m1/s1