2-[3-butyl-5-[(1E,3E,5E)-5-[1-butyl-3-(carboxymethyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]penta-1,3-dienyl]-6-oxidanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoic acid

Systemtic Name: 2-[3-butyl-5-[(1E,3E,5E)-5-[1-butyl-3-(carboxymethyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]penta-1,3-dienyl]-6-oxidanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoic acid Openeye Name: 2-[3-butyl-5-[(1E,3E,5E)-5-[1-butyl-3-(carboxymethyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]penta-1,3-dienyl]-6-hydroxy-2,4-dioxo-pyrimidin-1-yl]acetic acid CAS Name: 2-[3-butyl-5-[(1E,3E,5E)-5-[1-butyl-3-(carboxymethyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]penta-1,3-dienyl]-6-hydroxy-2,4-dioxo-1-pyrimidinyl]acetic acid IUPAC Name: 2-[3-butyl-5-[(1E,3E,5E)-5-[1-butyl-3-(carboxymethyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]penta-1,3-dienyl]-6-hydroxy-2,4-dioxopyrimidin-1-yl]acetic acid Traditional Name: 2-[3-butyl-5-[(1E,3E,5E)-5-[1-butyl-3-(carboxymethyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]penta-1,3-dienyl]-6-hydroxy-2,4-diketo-pyrimidin-1-yl]acetic acid Formula: C25H30N4O10 MolecularWeight: 546.5265

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(N(C1=O)CC(=O)O)O)C=CC=CC=C2C(=O)N(C(=O)N(C2=O)CC(=O)O)CCCC

Isomeric SMILES

CCCCN1C(=O)C(=C(N(C1=O)CC(=O)O)O)/C=C/C=C/C=C/2\C(=O)N(C(=O)N(C2=O)CC(=O)O)CCCC

InChI

InChI=1S/C25H30N4O10/c1-3-5-12-26-20(34)16(22(36)28(24(26)38)14-18(30)31)10-8-7-9-11-17-21(35)27(13-6-4-2)25(39)29(23(17)37)15-19(32)33/h7-11,36H,3-6,12-15H2,1-2H3,(H,30,31)(H,32,33)/b9-7+,10-8+,17-11+