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

Systemtic Name: 2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitro-4-(phenylmethyl)phenolate Openeye Name: 4-benzyl-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitro-phenolate CAS Name: 2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitro-4-(phenylmethyl)phenolate IUPAC Name: 4-benzyl-2-[(4-ethoxycarbonylphenyl)iminomethyl]-6-nitrophenolate Traditional Name: 4-benzyl-2-[(4-carbethoxyphenyl)iminomethyl]-6-nitro-phenolate Formula: C23H19N2O5- MolecularWeight: 403.40736

Click to see the large picture

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=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C23H20N2O5/c1-2-30-23(27)18-8-10-20(11-9-18)24-15-19-13-17(12-16-6-4-3-5-7-16)14-21(22(19)26)25(28)29/h3-11,13-15,26H,2,12H2,1H3/p-1