2-bromanyl-4-nitro-6-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)iminomethyl]phenolate

Systemtic Name: 2-bromanyl-4-nitro-6-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Openeye Name: 2-bromo-4-nitro-6-[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]iminomethyl]phenolate CAS Name: 2-bromo-4-nitro-6-[[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]iminomethyl]phenolate IUPAC Name: 2-bromo-4-nitro-6-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Traditional Name: 2-bromo-4-nitro-6-[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]iminomethyl]phenolate Formula: C19H10BrN4O4- MolecularWeight: 438.2111

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC3=C(O2)C=CC(=C3)N=CC4=CC(=CC(=C4[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C2=NC3=C(O2)C=CC(=C3)N=CC4=CC(=CC(=C4[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C19H11BrN4O4/c20-15-8-14(24(26)27)6-12(18(15)25)10-22-13-3-4-17-16(7-13)23-19(28-17)11-2-1-5-21-9-11/h1-10,25H/p-1