sodium N-[azanyl-[(3S)-3-benzamido-2-oxidanylidene-piperidin-1-yl]phosphoryl]sulfamate

Systemtic Name: sodium N-[azanyl-[(3S)-3-benzamido-2-oxidanylidene-piperidin-1-yl]phosphoryl]sulfamate Openeye Name: sodium N-[amino-[(3S)-3-benzamido-2-oxo-1-piperidyl]phosphoryl]sulfamate CAS Name: sodium N-[amino-[(3S)-3-benzamido-2-oxo-1-piperidinyl]phosphoryl]sulfamate IUPAC Name: sodium N-[amino-[(3S)-3-benzamido-2-oxopiperidin-1-yl]phosphoryl]sulfamate Traditional Name: sodium N-[amino-[(3S)-3-benzamido-2-keto-piperidino]phosphoryl]sulfamate Formula: C12H16N4NaO6PS MolecularWeight: 398.307171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)P(=O)(N)NS(=O)(=O)[O-])NC(=O)C2=CC=CC=C2.[Na+]

Isomeric SMILES

C1C[C@@H](C(=O)N(C1)P(=O)(N)NS(=O)(=O)[O-])NC(=O)C2=CC=CC=C2.[Na+]

InChI

InChI=1S/C12H17N4O6PS.Na/c13-23(19,15-24(20,21)22)16-8-4-7-10(12(16)18)14-11(17)9-5-2-1-3-6-9;/h1-3,5-6,10H,4,7-8H2,(H,14,17)(H3,13,15,19)(H,20,21,22);/q;+1/p-1/t10-,23?;/m0./s1