1-(5-chloranyl-2-methoxy-phenyl)-3-piperidin-1-yl-pyrrolidine-2,5-dione; ethanedioic acid

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-piperidin-1-yl-pyrrolidine-2,5-dione; ethanedioic acid Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(1-piperidyl)pyrrolidine-2,5-dione; oxalic acid CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(1-piperidinyl)pyrrolidine-2,5-dione; oxalic acid IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-piperidin-1-ylpyrrolidine-2,5-dione; oxalic acid Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-piperidino-pyrrolidine-2,5-quinone; oxalic acid Formula: C18H21ClN2O7 MolecularWeight: 412.82154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=O)CC(C2=O)N3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=O)CC(C2=O)N3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H19ClN2O3.C2H2O4/c1-22-14-6-5-11(17)9-12(14)19-15(20)10-13(16(19)21)18-7-3-2-4-8-18;3-1(4)2(5)6/h5-6,9,13H,2-4,7-8,10H2,1H3;(H,3,4)(H,5,6)