3-[6-[[(carboxylatoamino)-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]hexylamino]-3-oxidanylidene-2-phenylmethoxy-propanoate

Systemtic Name: 3-[6-[[(carboxylatoamino)-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]hexylamino]-3-oxidanylidene-2-phenylmethoxy-propanoate Openeye Name: 2-benzyloxy-3-[6-[[(tert-butoxycarbonylamino)-(carboxylatoamino)methylene]amino]hexylamino]-3-oxo-propanoate CAS Name: 3-[6-[[(carboxylatoamino)-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methylidene]amino]hexylamino]-3-oxo-2-phenylmethoxypropanoate IUPAC Name: 3-[6-[[(carboxylatoamino)-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]hexylamino]-3-oxo-2-phenylmethoxypropanoate Traditional Name: 2-benzoxy-3-[6-[[(tert-butoxycarbonylamino)-(carboxylatoamino)methylene]amino]hexylamino]-3-keto-propionate Formula: C23H32N4O8-2 MolecularWeight: 492.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCCCCCCNC(=O)C(C(=O)[O-])OCC1=CC=CC=C1)NC(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCCCCCCNC(=O)C(C(=O)[O-])OCC1=CC=CC=C1)NC(=O)[O-]

InChI

InChI=1S/C23H34N4O8/c1-23(2,3)35-22(33)27-20(26-21(31)32)25-14-10-5-4-9-13-24-18(28)17(19(29)30)34-15-16-11-7-6-8-12-16/h6-8,11-12,17H,4-5,9-10,13-15H2,1-3H3,(H,24,28)(H,29,30)(H,31,32)(H2,25,26,27,33)/p-2