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

Systemtic Name: 2-[[3-(2-methylpropanoylamino)phenyl]iminomethyl]-6-nitro-4-(phenylmethyl)phenolate Openeye Name: 4-benzyl-2-[[3-(2-methylpropanoylamino)phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 2-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]iminomethyl]-6-nitro-4-(phenylmethyl)phenolate IUPAC Name: 4-benzyl-2-[[3-(2-methylpropanoylamino)phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-benzyl-2-[[3-(isobutyrylamino)phenyl]iminomethyl]-6-nitro-phenolate Formula: C24H22N3O4- MolecularWeight: 416.44918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C24H23N3O4/c1-16(2)24(29)26-21-10-6-9-20(14-21)25-15-19-12-18(11-17-7-4-3-5-8-17)13-22(23(19)28)27(30)31/h3-10,12-16,28H,11H2,1-2H3,(H,26,29)/p-1