2-[2-[(5-cyanopyridin-2-yl)amino]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethanoic acid

Systemtic Name: 2-[2-[(5-cyanopyridin-2-yl)amino]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethanoic acid Openeye Name: 2-[tert-butoxycarbonyl-[2-[(5-cyano-2-pyridyl)amino]ethyl]amino]acetic acid CAS Name: 2-[2-[(5-cyano-2-pyridinyl)amino]ethyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid IUPAC Name: 2-[2-[(5-cyanopyridin-2-yl)amino]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetic acid Traditional Name: 2-[tert-butoxycarbonyl-[2-[(5-cyano-2-pyridyl)amino]ethyl]amino]acetic acid Formula: C15H20N4O4 MolecularWeight: 320.3437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCNC1=NC=C(C=C1)C#N)CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(CCNC1=NC=C(C=C1)C#N)CC(=O)O

InChI

InChI=1S/C15H20N4O4/c1-15(2,3)23-14(22)19(10-13(20)21)7-6-17-12-5-4-11(8-16)9-18-12/h4-5,9H,6-7,10H2,1-3H3,(H,17,18)(H,20,21)