3-[[(Z)-1-[1,3-dimethyl-4-oxidanyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]prop-1-enyl]amino]benzoic acid

Systemtic Name: 3-[[(Z)-1-[1,3-dimethyl-4-oxidanyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]prop-1-enyl]amino]benzoic acid Openeye Name: 3-[[(Z)-1-(4-hydroxy-1,3-dimethyl-2,6-dioxo-pyrimidin-5-yl)prop-1-enyl]amino]benzoic acid CAS Name: 3-[[(Z)-1-(4-hydroxy-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)prop-1-enyl]amino]benzoic acid IUPAC Name: 3-[[(Z)-1-(4-hydroxy-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)prop-1-enyl]amino]benzoic acid Traditional Name: 3-[[(Z)-1-(4-hydroxy-2,6-diketo-1,3-dimethyl-pyrimidin-5-yl)prop-1-enyl]amino]benzoic acid Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C(/C1=C(N(C(=O)N(C1=O)C)C)O)\NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H17N3O5/c1-4-11(17-10-7-5-6-9(8-10)15(22)23)12-13(20)18(2)16(24)19(3)14(12)21/h4-8,17,20H,1-3H3,(H,22,23)/b11-4-