2-[[(2S)-2-oxidanyl-2-phenyl-ethyl]carbamoyl]quinazolin-4-olate

Systemtic Name: 2-[[(2S)-2-oxidanyl-2-phenyl-ethyl]carbamoyl]quinazolin-4-olate Openeye Name: 2-[[(2S)-2-hydroxy-2-phenyl-ethyl]carbamoyl]quinazolin-4-olate CAS Name: 2-[[[(2S)-2-hydroxy-2-phenylethyl]amino]-oxomethyl]-4-quinazolinolate IUPAC Name: 2-[[(2S)-2-hydroxy-2-phenylethyl]carbamoyl]quinazolin-4-olate Traditional Name: 2-[[(2S)-2-hydroxy-2-phenyl-ethyl]carbamoyl]quinazolin-4-olate Formula: C17H14N3O3- MolecularWeight: 308.31136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)C2=NC3=CC=CC=C3C(=N2)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](CNC(=O)C2=NC3=CC=CC=C3C(=N2)[O-])O

InChI

InChI=1S/C17H15N3O3/c21-14(11-6-2-1-3-7-11)10-18-17(23)15-19-13-9-5-4-8-12(13)16(22)20-15/h1-9,14,21H,10H2,(H,18,23)(H,19,20,22)/p-1/t14-/m1/s1