1-(3-azanyl-3-methanoyl-4-methyl-2-oxidanylidene-pentyl)-3-(carboxymethyl)-2,6-bis(oxidanylidene)pyrimidine-4-carboxylic acid

Systemtic Name: 1-(3-azanyl-3-methanoyl-4-methyl-2-oxidanylidene-pentyl)-3-(carboxymethyl)-2,6-bis(oxidanylidene)pyrimidine-4-carboxylic acid Openeye Name: 1-(3-amino-3-formyl-4-methyl-2-oxo-pentyl)-3-(carboxymethyl)-2,6-dioxo-pyrimidine-4-carboxylic acid CAS Name: 1-(3-amino-3-formyl-4-methyl-2-oxopentyl)-3-(carboxymethyl)-2,6-dioxo-4-pyrimidinecarboxylic acid IUPAC Name: 1-(3-amino-3-formyl-4-methyl-2-oxopentyl)-3-(carboxymethyl)-2,6-dioxopyrimidine-4-carboxylic acid Traditional Name: 1-(3-amino-3-formyl-2-keto-4-methyl-pentyl)-3-(carboxymethyl)-2,6-diketo-pyrimidine-4-carboxylic acid Formula: C14H17N3O8 MolecularWeight: 355.30008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=O)(C(=O)CN1C(=O)C=C(N(C1=O)CC(=O)O)C(=O)O)N

Isomeric SMILES

CC(C)C(C=O)(C(=O)CN1C(=O)C=C(N(C1=O)CC(=O)O)C(=O)O)N

InChI

InChI=1S/C14H17N3O8/c1-7(2)14(15,6-18)9(19)4-17-10(20)3-8(12(23)24)16(13(17)25)5-11(21)22/h3,6-7H,4-5,15H2,1-2H3,(H,21,22)(H,23,24)