5-[[2-(cyclohexylmethylamino)phenyl]amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2-(cyclohexylmethylamino)phenyl]amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-5-[2-(cyclohexylmethylamino)anilino]-5-oxo-pentanoic acid CAS Name: 5-[2-(cyclohexylmethylamino)anilino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[2-(cyclohexylmethylamino)anilino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-5-[2-(cyclohexylmethylamino)anilino]-5-keto-valeric acid Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)NC1=CC=CC=C1NCC2CCCCC2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC(=O)NC1=CC=CC=C1NCC2CCCCC2)C(=O)O

InChI

InChI=1S/C23H35N3O5/c1-23(2,3)31-22(30)26-19(21(28)29)13-14-20(27)25-18-12-8-7-11-17(18)24-15-16-9-5-4-6-10-16/h7-8,11-12,16,19,24H,4-6,9-10,13-15H2,1-3H3,(H,25,27)(H,26,30)(H,28,29)