4-[(2-chlorophenyl)methyl]-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-[(2-chlorophenyl)methyl]-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-[(2-chlorophenyl)methyl]-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitro-phenolate CAS Name: 4-[(2-chlorophenyl)methyl]-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitrophenolate IUPAC Name: 4-[(2-chlorophenyl)methyl]-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitrophenolate Traditional Name: 2-[(4-carbethoxyphenyl)iminomethyl]-4-(2-chlorobenzyl)-6-nitro-phenolate Formula: C23H18ClN2O5- MolecularWeight: 437.85242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3Cl

InChI

InChI=1S/C23H19ClN2O5/c1-2-31-23(28)16-7-9-19(10-8-16)25-14-18-12-15(13-21(22(18)27)26(29)30)11-17-5-3-4-6-20(17)24/h3-10,12-14,27H,2,11H2,1H3/p-1