4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]amino]methyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidino-ethyl]amino]methyl]-6,7-dimethyl-coumarin Formula: C24H27ClN2O2 MolecularWeight: 410.93638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCC(C3=CC=CC=C3Cl)N4CCCC4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=CC=C3Cl)N4CCCC4)C

InChI

InChI=1S/C24H27ClN2O2/c1-16-11-20-18(13-24(28)29-23(20)12-17(16)2)14-26-15-22(27-9-5-6-10-27)19-7-3-4-8-21(19)25/h3-4,7-8,11-13,22,26H,5-6,9-10,14-15H2,1-2H3/t22-/m1/s1