6-[(2-methylphenyl)carbamoylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid

Systemtic Name: 6-[(2-methylphenyl)carbamoylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-6-(o-tolylcarbamoylamino)hexanoic acid CAS Name: 6-[[(2-methylanilino)-oxomethyl]amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(2-methylphenyl)carbamoylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-6-(o-tolylcarbamoylamino)hexanoic acid Formula: C19H29N3O5 MolecularWeight: 379.45066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NCCCCC(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NCCCCC(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H29N3O5/c1-13-9-5-6-10-14(13)21-17(25)20-12-8-7-11-15(16(23)24)22-18(26)27-19(2,3)4/h5-6,9-10,15H,7-8,11-12H2,1-4H3,(H,22,26)(H,23,24)(H2,20,21,25)