(E)-5,6-bis(aziridin-2-yl)-6-methyl-7-oxidanyl-7-oxidanylidene-hept-2-enoate

Systemtic Name: (E)-5,6-bis(aziridin-2-yl)-6-methyl-7-oxidanyl-7-oxidanylidene-hept-2-enoate Openeye Name: (E)-5,6-bis(aziridin-2-yl)-7-hydroxy-6-methyl-7-oxo-hept-2-enoate CAS Name: (E)-5,6-bis(2-aziridinyl)-7-hydroxy-6-methyl-7-oxo-2-heptenoate IUPAC Name: (E)-5,6-bis(aziridin-2-yl)-7-hydroxy-6-methyl-7-oxohept-2-enoate Traditional Name: (E)-5,6-di(ethylenimin-2-yl)-7-hydroxy-7-keto-6-methyl-hept-2-enoate Formula: C12H17N2O4- MolecularWeight: 253.27438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN1)(C(CC=CC(=O)[O-])C2CN2)C(=O)O

Isomeric SMILES

CC(C1CN1)(C(C/C=C/C(=O)[O-])C2CN2)C(=O)O

InChI

InChI=1S/C12H18N2O4/c1-12(11(17)18,9-6-14-9)7(8-5-13-8)3-2-4-10(15)16/h2,4,7-9,13-14H,3,5-6H2,1H3,(H,15,16)(H,17,18)/p-1/b4-2+