(5S)-4-[(5-chloranyl-2-methoxy-phenyl)-oxidanyl-methylidene]-1-(2-dimethylaminoethyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione

Systemtic Name: (5S)-4-[(5-chloranyl-2-methoxy-phenyl)-oxidanyl-methylidene]-1-(2-dimethylaminoethyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione Openeye Name: (5S)-4-[(5-chloro-2-methoxy-phenyl)-hydroxy-methylene]-1-(2-dimethylaminoethyl)-5-(4-pyridyl)pyrrolidine-2,3-dione CAS Name: (5S)-4-[(5-chloro-2-methoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-pyridin-4-ylpyrrolidine-2,3-dione IUPAC Name: (5S)-4-[(5-chloro-2-methoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-pyridin-4-ylpyrrolidine-2,3-dione Traditional Name: (5S)-4-[(5-chloro-2-methoxy-phenyl)-hydroxy-methylene]-1-(2-dimethylaminoethyl)-5-(4-pyridyl)pyrrolidine-2,3-quinone Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(C(=C(C2=C(C=CC(=C2)Cl)OC)O)C(=O)C1=O)C3=CC=NC=C3

Isomeric SMILES

CN(C)CCN1[C@H](C(=C(C2=C(C=CC(=C2)Cl)OC)O)C(=O)C1=O)C3=CC=NC=C3

InChI

InChI=1S/C21H22ClN3O4/c1-24(2)10-11-25-18(13-6-8-23-9-7-13)17(20(27)21(25)28)19(26)15-12-14(22)4-5-16(15)29-3/h4-9,12,18,26H,10-11H2,1-3H3/t18-/m0/s1