2,4-bis(2-ethylaziridin-1-yl)benzene-1,3-dicarboxylic acid

Systemtic Name: 2,4-bis(2-ethylaziridin-1-yl)benzene-1,3-dicarboxylic acid Openeye Name: 2,4-bis(2-ethylaziridin-1-yl)benzene-1,3-dicarboxylic acid CAS Name: 2,4-bis(2-ethyl-1-aziridinyl)benzene-1,3-dicarboxylic acid IUPAC Name: 2,4-bis(2-ethylaziridin-1-yl)benzene-1,3-dicarboxylic acid Traditional Name: 2,4-bis(2-ethylethylenimin-1-yl)isophthalic acid Formula: C16H20N2O4 MolecularWeight: 304.341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN1C2=C(C(=C(C=C2)C(=O)O)N3CC3CC)C(=O)O

Isomeric SMILES

CCC1CN1C2=C(C(=C(C=C2)C(=O)O)N3CC3CC)C(=O)O

InChI

InChI=1S/C16H20N2O4/c1-3-9-7-17(9)12-6-5-11(15(19)20)14(13(12)16(21)22)18-8-10(18)4-2/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,19,20)(H,21,22)