2-[4-[4-bromanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-butyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[4-bromanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-butyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[4-bromo-2-(tert-butoxycarbonylamino)-3-oxo-butyl]phenoxy]acetic acid CAS Name: 2-[4-[4-bromo-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxobutyl]phenoxy]acetic acid IUPAC Name: 2-[4-[4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxobutyl]phenoxy]acetic acid Traditional Name: 2-[4-[4-bromo-2-(tert-butoxycarbonylamino)-3-keto-butyl]phenoxy]acetic acid Formula: C17H22BrNO6 MolecularWeight: 416.26368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC(=O)O)C(=O)CBr

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC(=O)O)C(=O)CBr

InChI

InChI=1S/C17H22BrNO6/c1-17(2,3)25-16(23)19-13(14(20)9-18)8-11-4-6-12(7-5-11)24-10-15(21)22/h4-7,13H,8-10H2,1-3H3,(H,19,23)(H,21,22)