dimethyl 2-[[1-(phenylmethyl)aziridin-2-yl]carbonylamino]pentanedioate

Systemtic Name: dimethyl 2-[[1-(phenylmethyl)aziridin-2-yl]carbonylamino]pentanedioate Openeye Name: dimethyl 2-[(1-benzylaziridine-2-carbonyl)amino]pentanedioate CAS Name: 2-[[oxo-[1-(phenylmethyl)-2-aziridinyl]methyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1-benzylaziridine-2-carbonyl)amino]pentanedioate Traditional Name: 2-[(1-benzylethylenimine-2-carbonyl)amino]glutaric acid dimethyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)OC)NC(=O)C1CN1CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(C(=O)OC)NC(=O)C1CN1CC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O5/c1-23-15(20)9-8-13(17(22)24-2)18-16(21)14-11-19(14)10-12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3,(H,18,21)