2-[[2-oxidanylidene-2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]ethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name: 2-[[2-oxidanylidene-2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]ethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid Openeye Name: 2-[[2-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-2-oxo-ethyl]amino]-6-(benzyloxycarbonylamino)hexanoic acid CAS Name: 2-[[2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid IUPAC Name: 2-[[2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid Traditional Name: 2-[[2-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-2-keto-ethyl]amino]-6-(benzyloxycarbonylamino)hexanoic acid Formula: C25H31N3O7 MolecularWeight: 485.52954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CNC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CNC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C25H31N3O7/c29-22(28-21(24(32)33)15-18-9-3-1-4-10-18)16-27-20(23(30)31)13-7-8-14-26-25(34)35-17-19-11-5-2-6-12-19/h1-6,9-12,20-21,27H,7-8,13-17H2,(H,26,34)(H,28,29)(H,30,31)(H,32,33)