2-[4-[(2-azanyl-2-oxidanylidene-ethyl)amino]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoic acid

Systemtic Name: 2-[4-[(2-azanyl-2-oxidanylidene-ethyl)amino]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoic acid Openeye Name: 2-[4-[(2-amino-2-oxo-ethyl)amino]phenyl]-2-(tert-butoxycarbonylamino)acetic acid CAS Name: 2-[4-[(2-amino-2-oxoethyl)amino]phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid IUPAC Name: 2-[4-[(2-amino-2-oxoethyl)amino]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid Traditional Name: 2-[4-[(2-amino-2-keto-ethyl)amino]phenyl]-2-(tert-butoxycarbonylamino)acetic acid Formula: C15H21N3O5 MolecularWeight: 323.34434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=C(C=C1)NCC(=O)N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1=CC=C(C=C1)NCC(=O)N)C(=O)O

InChI

InChI=1S/C15H21N3O5/c1-15(2,3)23-14(22)18-12(13(20)21)9-4-6-10(7-5-9)17-8-11(16)19/h4-7,12,17H,8H2,1-3H3,(H2,16,19)(H,18,22)(H,20,21)