2-[[3-(carboxymethylimino)-5-(hydroxymethyl)-2-methoxy-5-oxidanyl-cyclohexen-1-yl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[3-(carboxymethylimino)-5-(hydroxymethyl)-2-methoxy-5-oxidanyl-cyclohexen-1-yl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[3-(carboxymethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxy-cyclohexen-1-yl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[3-(carboxymethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxy-1-cyclohexenyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[3-(carboxymethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxycyclohexen-1-yl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[3-(carboxymethylimino)-5-hydroxy-2-methoxy-5-methylol-cyclohexen-1-yl]amino]-3-hydroxy-propionic acid Formula: C13H20N2O8 MolecularWeight: 332.3065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(CC(CC1=NCC(=O)O)(CO)O)NC(CO)C(=O)O

Isomeric SMILES

COC1=C(CC(CC1=NCC(=O)O)(CO)O)NC(CO)C(=O)O

InChI

InChI=1S/C13H20N2O8/c1-23-11-7(14-4-10(18)19)2-13(22,6-17)3-8(11)15-9(5-16)12(20)21/h9,15-17,22H,2-6H2,1H3,(H,18,19)(H,20,21)