2-[3-(3-azanyl-3-methanoyl-4-methyl-2-oxidanylidene-pentyl)-2,4-bis(oxidanylidene)-6-phenylazanyl-pyrimidin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(3-azanyl-3-methanoyl-4-methyl-2-oxidanylidene-pentyl)-2,4-bis(oxidanylidene)-6-phenylazanyl-pyrimidin-1-yl]ethanoic acid Openeye Name: 2-[3-(3-amino-3-formyl-4-methyl-2-oxo-pentyl)-6-anilino-2,4-dioxo-pyrimidin-1-yl]acetic acid CAS Name: 2-[3-(3-amino-3-formyl-4-methyl-2-oxopentyl)-6-anilino-2,4-dioxo-1-pyrimidinyl]acetic acid IUPAC Name: 2-[3-(3-amino-3-formyl-4-methyl-2-oxopentyl)-6-anilino-2,4-dioxopyrimidin-1-yl]acetic acid Traditional Name: 2-[3-(3-amino-3-formyl-2-keto-4-methyl-pentyl)-6-anilino-2,4-diketo-pyrimidin-1-yl]acetic acid Formula: C19H22N4O6 MolecularWeight: 402.40118

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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)NC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C(C=O)(C(=O)CN1C(=O)C=C(N(C1=O)CC(=O)O)NC2=CC=CC=C2)N

InChI

InChI=1S/C19H22N4O6/c1-12(2)19(20,11-24)14(25)9-23-16(26)8-15(21-13-6-4-3-5-7-13)22(18(23)29)10-17(27)28/h3-8,11-12,21H,9-10,20H2,1-2H3,(H,27,28)