3-[3-(3-oxidanyl-3-oxidanylidene-prop-1-ynyl)phenyl]prop-2-ynoic acid; phenyldiazane

Systemtic Name: 3-[3-(3-oxidanyl-3-oxidanylidene-prop-1-ynyl)phenyl]prop-2-ynoic acid; phenyldiazane Openeye Name: 3-[3-(3-hydroxy-3-oxo-prop-1-ynyl)phenyl]prop-2-ynoic acid; phenylhydrazine CAS Name: 3-[3-(3-hydroxy-3-oxoprop-1-ynyl)phenyl]-2-propynoic acid; phenylhydrazine IUPAC Name: 3-[3-(3-hydroxy-3-oxoprop-1-ynyl)phenyl]prop-2-ynoic acid; phenylhydrazine Traditional Name: 3-[3-(3-hydroxy-3-keto-prop-1-ynyl)phenyl]propiolic acid; phenylhydrazine Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN.C1=CC=C(C=C1)NN.C1=CC(=CC(=C1)C#CC(=O)O)C#CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NN.C1=CC=C(C=C1)NN.C1=CC(=CC(=C1)C#CC(=O)O)C#CC(=O)O

InChI

InChI=1S/C12H6O4.2C6H8N2/c13-11(14)6-4-9-2-1-3-10(8-9)5-7-12(15)16;2*7-8-6-4-2-1-3-5-6/h1-3,8H,(H,13,14)(H,15,16);2*1-5,8H,7H2