oxidanylidene-(1-oxidanyl-6-oxidanylidene-6-phenylazanyl-hexan-3-yl)-[2-(phenylmethoxycarbonylamino)hexanoyl]azanium

Systemtic Name: oxidanylidene-(1-oxidanyl-6-oxidanylidene-6-phenylazanyl-hexan-3-yl)-[2-(phenylmethoxycarbonylamino)hexanoyl]azanium Openeye Name: [4-anilino-1-(2-hydroxyethyl)-4-oxo-butyl]-[2-(benzyloxycarbonylamino)hexanoyl]-oxo-ammonium CAS Name: (6-anilino-1-hydroxy-6-oxohexan-3-yl)-oxo-[1-oxo-2-(phenylmethoxycarbonylamino)hexyl]ammonium IUPAC Name: (6-anilino-1-hydroxy-6-oxohexan-3-yl)-oxo-[2-(phenylmethoxycarbonylamino)hexanoyl]azanium Traditional Name: [4-anilino-1-(2-hydroxyethyl)-4-keto-butyl]-[2-(benzyloxycarbonylamino)hexanoyl]-keto-ammonium Formula: C26H34N3O6+ MolecularWeight: 484.56466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[N+](=O)C(CCC(=O)NC1=CC=CC=C1)CCO)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCC(C(=O)[N+](=O)C(CCC(=O)NC1=CC=CC=C1)CCO)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H33N3O6/c1-2-3-14-23(28-26(33)35-19-20-10-6-4-7-11-20)25(32)29(34)22(17-18-30)15-16-24(31)27-21-12-8-5-9-13-21/h4-13,22-23,30H,2-3,14-19H2,1H3,(H-,27,28,31,33)/p+1