4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one

Systemtic Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]amino]methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[[[(2S)-2-(2-chlorophenyl)-2-pyrrolidino-ethyl]amino]methyl]-7,8-dimethyl-coumarin Formula: C24H27ClN2O2 MolecularWeight: 410.93638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNCC(C3=CC=CC=C3Cl)N4CCCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=CC=C3Cl)N4CCCC4)C

InChI

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