[(2S)-6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl]-(2-methylpropyl)-(4-nitrophenyl)sulfonyl-(phenylmethyl)sulfonyl-azanium

Systemtic Name: [(2S)-6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl]-(2-methylpropyl)-(4-nitrophenyl)sulfonyl-(phenylmethyl)sulfonyl-azanium Openeye Name: [(1S)-5-amino-1-carboxy-pentyl]-benzylsulfonyl-isobutyl-(4-nitrophenyl)sulfonyl-ammonium CAS Name: [(2S)-6-amino-1-hydroxy-1-oxohexan-2-yl]-(2-methylpropyl)-(4-nitrophenyl)sulfonyl-(phenylmethyl)sulfonylammonium IUPAC Name: [(2S)-6-amino-1-hydroxy-1-oxohexan-2-yl]-benzylsulfonyl-(2-methylpropyl)-(4-nitrophenyl)sulfonylazanium Traditional Name: [(1S)-5-amino-1-carboxy-pentyl]-benzylsulfonyl-isobutyl-nosyl-ammonium Formula: C23H32N3O8S2+ MolecularWeight: 542.64548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+](C(CCCCN)C(=O)O)(S(=O)(=O)CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C[N+]([C@@H](CCCCN)C(=O)O)(S(=O)(=O)CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C23H31N3O8S2/c1-18(2)16-26(22(23(27)28)10-6-7-15-24,35(31,32)17-19-8-4-3-5-9-19)36(33,34)21-13-11-20(12-14-21)25(29)30/h3-5,8-9,11-14,18,22H,6-7,10,15-17,24H2,1-2H3/p+1/t22-,26?/m0/s1