5-azanyl-2-[(2-azanyl-3-sulfo-propanoyl)amino]-3-oxidanylidene-pentane-1-sulfonic acid

Systemtic Name: 5-azanyl-2-[(2-azanyl-3-sulfo-propanoyl)amino]-3-oxidanylidene-pentane-1-sulfonic acid Openeye Name: 5-amino-2-[(2-amino-3-sulfo-propanoyl)amino]-3-oxo-pentane-1-sulfonic acid CAS Name: 5-amino-2-[(2-amino-1-oxo-3-sulfopropyl)amino]-3-oxo-1-pentanesulfonic acid IUPAC Name: 5-amino-2-[(2-amino-3-sulfopropanoyl)amino]-3-oxopentane-1-sulfonic acid Traditional Name: 5-amino-2-[(2-amino-3-sulfo-propanoyl)amino]-3-keto-pentane-1-sulfonic acid Formula: C8H17N3O8S2 MolecularWeight: 347.36588

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Descriptors Computed from Structure

Canonical SMILES:

C(CN)C(=O)C(CS(=O)(=O)O)NC(=O)C(CS(=O)(=O)O)N

Isomeric SMILES

C(CN)C(=O)C(CS(=O)(=O)O)NC(=O)C(CS(=O)(=O)O)N

InChI

InChI=1S/C8H17N3O8S2/c9-2-1-7(12)6(4-21(17,18)19)11-8(13)5(10)3-20(14,15)16/h5-6H,1-4,9-10H2,(H,11,13)(H,14,15,16)(H,17,18,19)