5-isocyanato-3,3-bis(2-isocyanatoethyl)-2-methylidene-pentanoic acid

Systemtic Name: 5-isocyanato-3,3-bis(2-isocyanatoethyl)-2-methylidene-pentanoic acid Openeye Name: 5-isocyanato-3,3-bis(2-isocyanatoethyl)-2-methylene-pentanoic acid CAS Name: 5-isocyanato-3,3-bis(2-isocyanatoethyl)-2-methylenepentanoic acid IUPAC Name: 5-isocyanato-3,3-bis(2-isocyanatoethyl)-2-methylidenepentanoic acid Traditional Name: 2-[3-isocyanato-1,1-bis(2-isocyanatoethyl)propyl]acrylic acid Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)O)C(CCN=C=O)(CCN=C=O)CCN=C=O

Isomeric SMILES

C=C(C(=O)O)C(CCN=C=O)(CCN=C=O)CCN=C=O

InChI

InChI=1S/C13H15N3O5/c1-11(12(20)21)13(2-5-14-8-17,3-6-15-9-18)4-7-16-10-19/h1-7H2,(H,20,21)