2-[bis(2-cyanoethyl)amino]-3-[1-(2-cyanoethyl)imidazol-4-yl]propanoic acid

Systemtic Name: 2-[bis(2-cyanoethyl)amino]-3-[1-(2-cyanoethyl)imidazol-4-yl]propanoic acid Openeye Name: 2-[bis(2-cyanoethyl)amino]-3-[1-(2-cyanoethyl)imidazol-4-yl]propanoic acid CAS Name: 2-[bis(2-cyanoethyl)amino]-3-[1-(2-cyanoethyl)-4-imidazolyl]propanoic acid IUPAC Name: 2-[bis(2-cyanoethyl)amino]-3-[1-(2-cyanoethyl)imidazol-4-yl]propanoic acid Traditional Name: 2-[bis(2-cyanoethyl)amino]-3-[1-(2-cyanoethyl)imidazol-4-yl]propionic acid Formula: C15H18N6O2 MolecularWeight: 314.34242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=CN1CCC#N)CC(C(=O)O)N(CCC#N)CCC#N

Isomeric SMILES

C1=C(N=CN1CCC#N)CC(C(=O)O)N(CCC#N)CCC#N

InChI

InChI=1S/C15H18N6O2/c16-4-1-7-20-11-13(19-12-20)10-14(15(22)23)21(8-2-5-17)9-3-6-18/h11-12,14H,1-3,7-10H2,(H,22,23)