(3R,4R,5S)-4-acetamido-5-[bis(azanyl)methylideneamino]-3-oxidanyl-cyclohexene-1-carboxylic acid

Systemtic Name: (3R,4R,5S)-4-acetamido-5-[bis(azanyl)methylideneamino]-3-oxidanyl-cyclohexene-1-carboxylic acid Openeye Name: (3R,4R,5S)-4-acetamido-5-guanidino-3-hydroxy-cyclohexene-1-carboxylic acid CAS Name: (3R,4R,5S)-4-acetamido-5-(diaminomethylideneamino)-3-hydroxy-1-cyclohexenecarboxylic acid IUPAC Name: (3R,4R,5S)-4-acetamido-5-(diaminomethylideneamino)-3-hydroxycyclohexene-1-carboxylic acid Traditional Name: (3R,4R,5S)-4-acetamido-5-guanidino-3-hydroxy-cyclohexene-1-carboxylic acid Formula: C10H16N4O4 MolecularWeight: 256.25844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(=CC1O)C(=O)O)N=C(N)N

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](CC(=C[C@H]1O)C(=O)O)N=C(N)N

InChI

InChI=1S/C10H16N4O4/c1-4(15)13-8-6(14-10(11)12)2-5(9(17)18)3-7(8)16/h3,6-8,16H,2H2,1H3,(H,13,15)(H,17,18)(H4,11,12,14)/t6-,7+,8+/m0/s1