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

Systemtic Name: [2-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methoxycarbonyl]phenyl] 2-acetyloxybenzoate Openeye Name: [2-[(2-amino-4-oxo-1H-pteridin-6-yl)methoxycarbonyl]phenyl] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic 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-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [2-[(2-amino-4-keto-1H-pteridin-6-yl)methoxycarbonyl]phenyl] ester Formula: C23H17N5O7 MolecularWeight: 475.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OC2=CC=CC=C2C(=O)OCC3=CN=C4C(=N3)C(=O)N=C(N4)N

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OC2=CC=CC=C2C(=O)OCC3=CN=C4C(=N3)C(=O)N=C(N4)N

InChI

InChI=1S/C23H17N5O7/c1-12(29)34-16-8-4-3-7-15(16)22(32)35-17-9-5-2-6-14(17)21(31)33-11-13-10-25-19-18(26-13)20(30)28-23(24)27-19/h2-10H,11H2,1H3,(H3,24,25,27,28,30)