3-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethoxycarbonylamino)amino]propanoyl-oxidanylidene-(1-oxidanyl-5-phenyl-pentan-3-yl)azanium

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethoxycarbonylamino)amino]propanoyl-oxidanylidene-(1-oxidanyl-5-phenyl-pentan-3-yl)azanium Openeye Name: 3-[benzyloxycarbonylamino(tert-butoxycarbonyl)amino]propanoyl-[1-(2-hydroxyethyl)-3-phenyl-propyl]-oxo-ammonium CAS Name: (1-hydroxy-5-phenylpentan-3-yl)-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethoxycarbonylamino)amino]-1-oxopropyl]-oxoammonium IUPAC Name: (1-hydroxy-5-phenylpentan-3-yl)-[3-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethoxycarbonylamino)amino]propanoyl]-oxoazanium Traditional Name: 3-[benzyloxycarbonylamino(tert-butoxycarbonyl)amino]propanoyl-[1-(2-hydroxyethyl)-3-phenyl-propyl]-keto-ammonium Formula: C27H36N3O7+ MolecularWeight: 514.59064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCC(=O)[N+](=O)C(CCC1=CC=CC=C1)CCO)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCC(=O)[N+](=O)C(CCC1=CC=CC=C1)CCO)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H35N3O7/c1-27(2,3)37-26(34)29(28-25(33)36-20-22-12-8-5-9-13-22)18-16-24(32)30(35)23(17-19-31)15-14-21-10-6-4-7-11-21/h4-13,23,31H,14-20H2,1-3H3/p+1