1-[4-[2-bromoethyl(methyl)amino]but-2-ynyl]-5-methyl-pyrrolidin-2-one; ethanedioic acid

Systemtic Name: 1-[4-[2-bromoethyl(methyl)amino]but-2-ynyl]-5-methyl-pyrrolidin-2-one; ethanedioic acid Openeye Name: 1-[4-[2-bromoethyl(methyl)amino]but-2-ynyl]-5-methyl-pyrrolidin-2-one; oxalic acid CAS Name: 1-[4-[2-bromoethyl(methyl)amino]but-2-ynyl]-5-methyl-2-pyrrolidinone; oxalic acid IUPAC Name: 1-[4-[2-bromoethyl(methyl)amino]but-2-ynyl]-5-methylpyrrolidin-2-one; oxalic acid Traditional Name: 1-[4-[2-bromoethyl(methyl)amino]but-2-ynyl]-5-methyl-2-pyrrolidone; oxalic acid Formula: C14H21BrN2O5 MolecularWeight: 377.23094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)N1CC#CCN(C)CCBr.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCC(=O)N1CC#CCN(C)CCBr.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H19BrN2O.C2H2O4/c1-11-5-6-12(16)15(11)9-4-3-8-14(2)10-7-13;3-1(4)2(5)6/h11H,5-10H2,1-2H3;(H,3,4)(H,5,6)