3-[(7-phenylpteridin-4-yl)amino]benzoate

Systemtic Name: 3-[(7-phenylpteridin-4-yl)amino]benzoate Openeye Name: 3-[(7-phenylpteridin-4-yl)amino]benzoate CAS Name: 3-[(7-phenyl-4-pteridinyl)amino]benzoate IUPAC Name: 3-[(7-phenylpteridin-4-yl)amino]benzoate Traditional Name: 3-[(7-phenylpteridin-4-yl)amino]benzoate Formula: C19H12N5O2- MolecularWeight: 342.33088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C3C(=N2)N=CN=C3NC4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C3C(=N2)N=CN=C3NC4=CC=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C19H13N5O2/c25-19(26)13-7-4-8-14(9-13)23-17-16-18(22-11-21-17)24-15(10-20-16)12-5-2-1-3-6-12/h1-11H,(H,25,26)(H,21,22,23,24)/p-1