2-azanyl-5-[[1-(carboxymethylamino)-3-[(2Z)-3-ethoxy-2-methoxyimino-3-oxidanylidene-propyl]sulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[1-(carboxymethylamino)-3-[(2Z)-3-ethoxy-2-methoxyimino-3-oxidanylidene-propyl]sulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[2-(carboxymethylamino)-1-[[(2Z)-3-ethoxy-2-methoxyimino-3-oxo-propyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[1-(carboxymethylamino)-3-[[(2Z)-3-ethoxy-2-methoxyimino-3-oxopropyl]thio]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[1-(carboxymethylamino)-3-[(2Z)-3-ethoxy-2-methoxyimino-3-oxopropyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[2-(carboxymethylamino)-1-[[[(2Z)-3-ethoxy-3-keto-2-methyloximino-propyl]thio]methyl]-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C16H26N4O9S MolecularWeight: 450.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NOC)CSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

CCOC(=O)/C(=N/OC)/CSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C16H26N4O9S/c1-3-29-16(27)11(20-28-2)8-30-7-10(14(24)18-6-13(22)23)19-12(21)5-4-9(17)15(25)26/h9-10H,3-8,17H2,1-2H3,(H,18,24)(H,19,21)(H,22,23)(H,25,26)/b20-11+