3-[(4-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)amino]benzoate

Systemtic Name: 3-[(4-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)amino]benzoate Openeye Name: 3-[(4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)amino]benzoate CAS Name: 3-[(4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)amino]benzoate IUPAC Name: 3-[(4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)amino]benzoate Traditional Name: 3-[(4-keto-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)amino]benzoate Formula: C14H12N3O3- MolecularWeight: 270.26338

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)NC(=NC2=O)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)NC(=NC2=O)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C14H13N3O3/c18-12-10-5-2-6-11(10)16-14(17-12)15-9-4-1-3-8(7-9)13(19)20/h1,3-4,7H,2,5-6H2,(H,19,20)(H2,15,16,17,18)/p-1