2-[(2R)-1-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydroquinazolin-2-yl]-4-chloranyl-6-nitro-phenolate

Systemtic Name: 2-[(2R)-1-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydroquinazolin-2-yl]-4-chloranyl-6-nitro-phenolate Openeye Name: 2-[(2R)-1-(2-amino-2-oxo-ethyl)-4-oxo-2,3-dihydroquinazolin-2-yl]-4-chloro-6-nitro-phenolate CAS Name: 2-[(2R)-1-(2-amino-2-oxoethyl)-4-oxo-2,3-dihydroquinazolin-2-yl]-4-chloro-6-nitrophenolate IUPAC Name: 2-[(2R)-1-(2-amino-2-oxoethyl)-4-oxo-2,3-dihydroquinazolin-2-yl]-4-chloro-6-nitrophenolate Traditional Name: 2-[(2R)-1-(2-amino-2-keto-ethyl)-4-keto-2,3-dihydroquinazolin-2-yl]-4-chloro-6-nitro-phenolate Formula: C16H12ClN4O5- MolecularWeight: 375.74328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(N2CC(=O)N)C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N[C@H](N2CC(=O)N)C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C16H13ClN4O5/c17-8-5-10(14(23)12(6-8)21(25)26)15-19-16(24)9-3-1-2-4-11(9)20(15)7-13(18)22/h1-6,15,23H,7H2,(H2,18,22)(H,19,24)/p-1/t15-/m1/s1