(Z)-2-(1,5-diisocyanatopentan-3-yl)but-2-enedioic acid

Systemtic Name: (Z)-2-(1,5-diisocyanatopentan-3-yl)but-2-enedioic acid Openeye Name: (Z)-2-[3-isocyanato-1-(2-isocyanatoethyl)propyl]but-2-enedioic acid CAS Name: (Z)-2-(1,5-diisocyanatopentan-3-yl)-2-butenedioic acid IUPAC Name: (Z)-2-(1,5-diisocyanatopentan-3-yl)but-2-enedioic acid Traditional Name: (Z)-2-[3-isocyanato-1-(2-isocyanatoethyl)propyl]but-2-enedioic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

C(CN=C=O)C(CCN=C=O)C(=CC(=O)O)C(=O)O

Isomeric SMILES

C(CN=C=O)C(CCN=C=O)/C(=C/C(=O)O)/C(=O)O

InChI

InChI=1S/C11H12N2O6/c14-6-12-3-1-8(2-4-13-7-15)9(11(18)19)5-10(16)17/h5,8H,1-4H2,(H,16,17)(H,18,19)/b9-5-