(2E,4Z)-3,4-bis(4-isocyanatobutyl)hexa-2,4-dienedioate

Systemtic Name: (2E,4Z)-3,4-bis(4-isocyanatobutyl)hexa-2,4-dienedioate Openeye Name: (2E,4Z)-3,4-bis(4-isocyanatobutyl)hexa-2,4-dienedioate CAS Name: (2E,4Z)-3,4-bis(4-isocyanatobutyl)hexa-2,4-dienedioate IUPAC Name: (2E,4Z)-3,4-bis(4-isocyanatobutyl)hexa-2,4-dienedioate Traditional Name: (2E,4Z)-3,4-bis(4-isocyanatobutyl)muconate Formula: C16H18N2O6-2 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN=C=O)CC(=CC(=O)[O-])C(=CC(=O)[O-])CCCCN=C=O

Isomeric SMILES

C(CCN=C=O)C/C(=C\C(=O)[O-])/C(=C\C(=O)[O-])/CCCCN=C=O

InChI

InChI=1S/C16H20N2O6/c19-11-17-7-3-1-5-13(9-15(21)22)14(10-16(23)24)6-2-4-8-18-12-20/h9-10H,1-8H2,(H,21,22)(H,23,24)/p-2/b13-9-,14-10+