2-methyl-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate

Systemtic Name: 2-methyl-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate Openeye Name: 2-methyl-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate CAS Name: 2-methyl-4-nitro-6-[[4-(1-oxopropylamino)phenyl]iminomethyl]phenolate IUPAC Name: 2-methyl-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate Traditional Name: 2-methyl-4-nitro-6-[(4-propionamidophenyl)iminomethyl]phenolate Formula: C17H16N3O4- MolecularWeight: 326.32664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4/c1-3-16(21)19-14-6-4-13(5-7-14)18-10-12-9-15(20(23)24)8-11(2)17(12)22/h4-10,22H,3H2,1-2H3,(H,19,21)/p-1