2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-ynyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-ynyl]phenyl]ethanoic acid Openeye Name: 2-[4-[3-(tert-butoxycarbonylamino)prop-2-ynyl]phenyl]acetic acid CAS Name: 2-[4-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]prop-2-ynyl]phenyl]acetic acid IUPAC Name: 2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-ynyl]phenyl]acetic acid Traditional Name: 2-[4-[3-(tert-butoxycarbonylamino)prop-2-ynyl]phenyl]acetic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC#CCC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC#CCC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C16H19NO4/c1-16(2,3)21-15(20)17-10-4-5-12-6-8-13(9-7-12)11-14(18)19/h6-9H,5,11H2,1-3H3,(H,17,20)(H,18,19)