5-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]-2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 5-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]-2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 5-[[3-(hydrazinomethyleneamino)benzoyl]amino]-2-[(E)-3-hydroxy-3-oxo-prop-1-enyl]benzoic acid CAS Name: 5-[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]-2-[(E)-3-hydroxy-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 5-[[3-(hydrazinylmethylideneamino)benzoyl]amino]-2-[(E)-3-hydroxy-3-oxoprop-1-enyl]benzoic acid Traditional Name: 5-[[3-(hydrazinomethyleneamino)benzoyl]amino]-2-[(E)-3-hydroxy-3-keto-prop-1-enyl]benzoic acid Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=CNN)C(=O)NC2=CC(=C(C=C2)C=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N=CNN)C(=O)NC2=CC(=C(C=C2)/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C18H16N4O5/c19-21-10-20-13-3-1-2-12(8-13)17(25)22-14-6-4-11(5-7-16(23)24)15(9-14)18(26)27/h1-10H,19H2,(H,20,21)(H,22,25)(H,23,24)(H,26,27)/b7-5+