[(5R)-6-oxidanylidene-6-phenylmethoxy-5-(phenylmethoxycarbonylamino)hexyl]azanium

Systemtic Name: [(5R)-6-oxidanylidene-6-phenylmethoxy-5-(phenylmethoxycarbonylamino)hexyl]azanium Openeye Name: [(5R)-6-benzyloxy-5-(benzyloxycarbonylamino)-6-oxo-hexyl]ammonium CAS Name: [(5R)-6-oxo-6-phenylmethoxy-5-(phenylmethoxycarbonylamino)hexyl]ammonium IUPAC Name: [(5R)-6-oxo-6-phenylmethoxy-5-(phenylmethoxycarbonylamino)hexyl]azanium Traditional Name: [(5R)-6-benzoxy-5-(benzyloxycarbonylamino)-6-keto-hexyl]ammonium Formula: C21H27N2O4+ MolecularWeight: 371.45008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCCC[NH3+])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)[C@@H](CCCC[NH3+])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O4/c22-14-8-7-13-19(20(24)26-15-17-9-3-1-4-10-17)23-21(25)27-16-18-11-5-2-6-12-18/h1-6,9-12,19H,7-8,13-16,22H2,(H,23,25)/p+1/t19-/m1/s1