2-[(3-methylphenyl)iminomethyl]-6-nitro-4-(phenylmethyl)phenolate

Systemtic Name: 2-[(3-methylphenyl)iminomethyl]-6-nitro-4-(phenylmethyl)phenolate Openeye Name: 4-benzyl-2-(m-tolyliminomethyl)-6-nitro-phenolate CAS Name: 2-[(3-methylphenyl)iminomethyl]-6-nitro-4-(phenylmethyl)phenolate IUPAC Name: 4-benzyl-2-[(3-methylphenyl)iminomethyl]-6-nitrophenolate Traditional Name: 4-benzyl-2-(m-tolyliminomethyl)-6-nitro-phenolate Formula: C21H17N2O3- MolecularWeight: 345.37128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O3/c1-15-6-5-9-19(10-15)22-14-18-12-17(11-16-7-3-2-4-8-16)13-20(21(18)24)23(25)26/h2-10,12-14,24H,11H2,1H3/p-1