2-azanyl-5-[[2-(carboxymethylamino)-1-(4-nitrososulfanyloxan-4-yl)-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[2-(carboxymethylamino)-1-(4-nitrososulfanyloxan-4-yl)-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[2-(carboxymethylamino)-1-(4-nitrososulfanyltetrahydropyran-4-yl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[2-(carboxymethylamino)-1-[4-(nitrosothio)-4-oxanyl]-2-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[2-(carboxymethylamino)-1-(4-nitrososulfanyloxan-4-yl)-2-oxoethyl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[2-(carboxymethylamino)-2-keto-1-[4-(nitrosothio)tetrahydropyran-4-yl]ethyl]amino]-5-keto-valeric acid Formula: C14H22N4O8S MolecularWeight: 406.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)SN=O

Isomeric SMILES

C1COCCC1(C(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)SN=O

InChI

InChI=1S/C14H22N4O8S/c15-8(13(23)24)1-2-9(19)17-11(12(22)16-7-10(20)21)14(27-18-25)3-5-26-6-4-14/h8,11H,1-7,15H2,(H,16,22)(H,17,19)(H,20,21)(H,23,24)