3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoylamino]benzoic acid

Systemtic Name: 3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoylamino]benzoic acid Openeye Name: 3-[3-(tert-butoxycarbonylamino)propylcarbamoylamino]benzoic acid CAS Name: 3-[[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylamino]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoylamino]benzoic acid Traditional Name: 3-[3-(tert-butoxycarbonylamino)propylcarbamoylamino]benzoic acid Formula: C16H23N3O5 MolecularWeight: 337.37092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O5/c1-16(2,3)24-15(23)18-9-5-8-17-14(22)19-12-7-4-6-11(10-12)13(20)21/h4,6-7,10H,5,8-9H2,1-3H3,(H,18,23)(H,20,21)(H2,17,19,22)