5-(3-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid

Systemtic Name: 5-(3-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-5-(3-cyanophenyl)pentanoic acid CAS Name: 5-(3-cyanophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid IUPAC Name: 5-(3-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-5-(3-cyanophenyl)valeric acid Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC1=CC=CC(=C1)C#N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC1=CC=CC(=C1)C#N)C(=O)O

InChI

InChI=1S/C17H22N2O4/c1-17(2,3)23-16(22)19-14(15(20)21)9-5-7-12-6-4-8-13(10-12)11-18/h4,6,8,10,14H,5,7,9H2,1-3H3,(H,19,22)(H,20,21)