bis[5-(aziridin-2-yl)pentyl] benzene-1,3-dicarboxylate

Systemtic Name: bis[5-(aziridin-2-yl)pentyl] benzene-1,3-dicarboxylate Openeye Name: bis[5-(aziridin-2-yl)pentyl] benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis[5-(2-aziridinyl)pentyl] ester IUPAC Name: bis[5-(aziridin-2-yl)pentyl] benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis(5-ethylenimin-2-ylpentyl) ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1)CCCCCOC(=O)C2=CC(=CC=C2)C(=O)OCCCCCC3CN3

Isomeric SMILES

C1C(N1)CCCCCOC(=O)C2=CC(=CC=C2)C(=O)OCCCCCC3CN3

InChI

InChI=1S/C22H32N2O4/c25-21(27-12-5-1-3-10-19-15-23-19)17-8-7-9-18(14-17)22(26)28-13-6-2-4-11-20-16-24-20/h7-9,14,19-20,23-24H,1-6,10-13,15-16H2