2-azanyl-2-(2-cyclohexylethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-hexanedioic acid

Systemtic Name: 2-azanyl-2-(2-cyclohexylethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-hexanedioic acid Openeye Name: 2-amino-4-(tert-butoxycarbonylamino)-2-(2-cyclohexylethyl)-3-oxo-hexanedioic acid CAS Name: 2-amino-2-(2-cyclohexylethyl)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxohexanedioic acid IUPAC Name: 2-amino-2-(2-cyclohexylethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxohexanedioic acid Traditional Name: 2-amino-4-(tert-butoxycarbonylamino)-2-(2-cyclohexylethyl)-3-keto-adipic acid Formula: C19H32N2O7 MolecularWeight: 400.46658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)O)C(=O)C(CCC1CCCCC1)(C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)O)C(=O)C(CCC1CCCCC1)(C(=O)O)N

InChI

InChI=1S/C19H32N2O7/c1-18(2,3)28-17(27)21-13(11-14(22)23)15(24)19(20,16(25)26)10-9-12-7-5-4-6-8-12/h12-13H,4-11,20H2,1-3H3,(H,21,27)(H,22,23)(H,25,26)