[2-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methoxycarbonyl]phenyl] 2-oxidanylbenzoate

Systemtic Name: [2-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methoxycarbonyl]phenyl] 2-oxidanylbenzoate Openeye Name: [2-[(2-amino-4-oxo-1H-pteridin-6-yl)methoxycarbonyl]phenyl] 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [2-[(2-amino-4-oxo-1H-pteridin-6-yl)methoxy-oxomethyl]phenyl] ester IUPAC Name: [2-[(2-amino-4-oxo-1H-pteridin-6-yl)methoxycarbonyl]phenyl] 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [2-[(2-amino-4-keto-1H-pteridin-6-yl)methoxycarbonyl]phenyl] ester Formula: C21H15N5O6 MolecularWeight: 433.3737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=CC=CC=C2C(=O)OCC3=CN=C4C(=N3)C(=O)N=C(N4)N)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=CC=CC=C2C(=O)OCC3=CN=C4C(=N3)C(=O)N=C(N4)N)O

InChI

InChI=1S/C21H15N5O6/c22-21-25-17-16(18(28)26-21)24-11(9-23-17)10-31-19(29)13-6-2-4-8-15(13)32-20(30)12-5-1-3-7-14(12)27/h1-9,27H,10H2,(H3,22,23,25,26,28)