2-[3-(azidomethyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-phenyl]ethanoic acid

Systemtic Name: 2-[3-(azidomethyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-phenyl]ethanoic acid Openeye Name: 2-[3-(azidomethyl)-2-(tert-butoxycarbonylamino)-4-hydroxy-phenyl]acetic acid CAS Name: 2-[3-(azidomethyl)-4-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]acetic acid IUPAC Name: 2-[3-(azidomethyl)-4-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]acetic acid Traditional Name: 2-[3-(azidomethyl)-2-(tert-butoxycarbonylamino)-4-hydroxy-phenyl]acetic acid Formula: C14H18N4O5 MolecularWeight: 322.31652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1CN=[N+]=[N-])O)CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1CN=[N+]=[N-])O)CC(=O)O

InChI

InChI=1S/C14H18N4O5/c1-14(2,3)23-13(22)17-12-8(6-11(20)21)4-5-10(19)9(12)7-16-18-15/h4-5,19H,6-7H2,1-3H3,(H,17,22)(H,20,21)