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

Systemtic Name: 4-chloranyl-2-nitro-6-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Openeye Name: 4-chloro-2-nitro-6-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]iminomethyl]phenolate CAS Name: 4-chloro-2-nitro-6-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenolate IUPAC Name: 4-chloro-2-nitro-6-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Traditional Name: 4-chloro-2-nitro-6-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]iminomethyl]phenolate Formula: C19H10ClN4O4- MolecularWeight: 393.7601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl)N=C(O2)C4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(C=C1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl)N=C(O2)C4=CC=NC=C4

InChI

InChI=1S/C19H11ClN4O4/c20-13-7-12(18(25)16(8-13)24(26)27)10-22-14-1-2-17-15(9-14)23-19(28-17)11-3-5-21-6-4-11/h1-10,25H/p-1