3-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]benzoic acid

Systemtic Name: 3-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]benzoic acid Openeye Name: 3-[[2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]amino]benzoic acid CAS Name: 3-[[3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]benzoic acid Traditional Name: 3-[[2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]amino]benzoic acid Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H24N2O5/c1-10(2)13(19-16(23)24-17(3,4)5)14(20)18-12-8-6-7-11(9-12)15(21)22/h6-10,13H,1-5H3,(H,18,20)(H,19,23)(H,21,22)