sodium 3-(1-acetamido-2-oxidanyl-ethyl)-4-[bis(azanyl)methylideneamino]cyclopentane-1-carboxylate

Systemtic Name: sodium 3-(1-acetamido-2-oxidanyl-ethyl)-4-[bis(azanyl)methylideneamino]cyclopentane-1-carboxylate Openeye Name: sodium 3-(1-acetamido-2-hydroxy-ethyl)-4-guanidino-cyclopentanecarboxylate CAS Name: sodium 3-(1-acetamido-2-hydroxyethyl)-4-(diaminomethylideneamino)-1-cyclopentanecarboxylate IUPAC Name: sodium 3-(1-acetamido-2-hydroxyethyl)-4-(diaminomethylideneamino)cyclopentane-1-carboxylate Traditional Name: sodium 3-(1-acetamido-2-hydroxy-ethyl)-4-guanidino-cyclopentanecarboxylate Formula: C11H19N4NaO4 MolecularWeight: 294.28273

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CO)C1CC(CC1N=C(N)N)C(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)NC(CO)C1CC(CC1N=C(N)N)C(=O)[O-].[Na+]

InChI

InChI=1S/C11H20N4O4.Na/c1-5(17)14-9(4-16)7-2-6(10(18)19)3-8(7)15-11(12)13;/h6-9,16H,2-4H2,1H3,(H,14,17)(H,18,19)(H4,12,13,15);/q;+1/p-1