4-chloranyl-2-[[4-[5-(hydroxymethyl)furan-2-yl]-3-methyl-phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[[4-[5-(hydroxymethyl)furan-2-yl]-3-methyl-phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[[4-[5-(hydroxymethyl)-2-furyl]-3-methyl-phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[[4-[5-(hydroxymethyl)-2-furanyl]-3-methylphenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[[4-[5-(hydroxymethyl)furan-2-yl]-3-methylphenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[[3-methyl-4-(5-methylol-2-furyl)phenyl]iminomethyl]-6-nitro-phenolate Formula: C19H14ClN2O5- MolecularWeight: 385.77786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl)C3=CC=C(O3)CO

Isomeric SMILES

CC1=C(C=CC(=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl)C3=CC=C(O3)CO

InChI

InChI=1S/C19H15ClN2O5/c1-11-6-14(2-4-16(11)18-5-3-15(10-23)27-18)21-9-12-7-13(20)8-17(19(12)24)22(25)26/h2-9,23-24H,10H2,1H3/p-1