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

Systemtic Name: 4-[[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[[(2S)-2-(dimethylamino)-2-phenylethyl]amino]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-(dimethylamino)-2-phenylethyl]amino]methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]methyl]-7,8-dimethyl-coumarin Formula: C22H26N2O2 MolecularWeight: 350.45404

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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)N(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2/c1-15-10-11-19-18(12-21(25)26-22(19)16(15)2)13-23-14-20(24(3)4)17-8-6-5-7-9-17/h5-12,20,23H,13-14H2,1-4H3/t20-/m1/s1