oxidanylidene-(1-oxidanyl-5-phenyl-pentan-3-yl)-[2-(phenylmethoxycarbonylamino)hexanoyl]azanium

Systemtic Name: oxidanylidene-(1-oxidanyl-5-phenyl-pentan-3-yl)-[2-(phenylmethoxycarbonylamino)hexanoyl]azanium Openeye Name: 2-(benzyloxycarbonylamino)hexanoyl-[1-(2-hydroxyethyl)-3-phenyl-propyl]-oxo-ammonium CAS Name: (1-hydroxy-5-phenylpentan-3-yl)-oxo-[1-oxo-2-(phenylmethoxycarbonylamino)hexyl]ammonium IUPAC Name: (1-hydroxy-5-phenylpentan-3-yl)-oxo-[2-(phenylmethoxycarbonylamino)hexanoyl]azanium Traditional Name: 2-(benzyloxycarbonylamino)hexanoyl-[1-(2-hydroxyethyl)-3-phenyl-propyl]-keto-ammonium Formula: C25H33N2O5+ MolecularWeight: 441.53992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O5/c1-2-3-14-23(26-25(30)32-19-21-12-8-5-9-13-21)24(29)27(31)22(17-18-28)16-15-20-10-6-4-7-11-20/h4-13,22-23,28H,2-3,14-19H2,1H3/p+1