(E)-[[(E)-3-azanyl-1-oxidanylidene-1-phenylazanyl-but-2-en-2-yl]amino]-(4-azanylperoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)azanium

Systemtic Name: (E)-[[(E)-3-azanyl-1-oxidanylidene-1-phenylazanyl-but-2-en-2-yl]amino]-(4-azanylperoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)azanium Openeye Name: (E)-(4-aminoperoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-[[(E)-2-amino-1-(phenylcarbamoyl)prop-1-enyl]amino]ammonium CAS Name: (E)-[[(E)-3-amino-1-anilino-1-oxobut-2-en-2-yl]amino]-(4-aminodioxy-6-oxo-1-cyclohexa-2,4-dienylidene)ammonium IUPAC Name: (E)-[[(E)-3-amino-1-anilino-1-oxobut-2-en-2-yl]amino]-(4-aminoperoxy-6-oxocyclohexa-2,4-dien-1-ylidene)azanium Traditional Name: (E)-(4-aminoperoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-[[(E)-2-amino-1-(phenylcarbamoyl)prop-1-enyl]amino]ammonium Formula: C16H18N5O4+ MolecularWeight: 344.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)NC1=CC=CC=C1)N[NH+]=C2C=CC(=CC2=O)OON)N

Isomeric SMILES

C/C(=C(/C(=O)NC1=CC=CC=C1)\N/[NH+]=C/2\C=CC(=CC2=O)OON)/N

InChI

InChI=1S/C16H17N5O4/c1-10(17)15(16(23)19-11-5-3-2-4-6-11)21-20-13-8-7-12(24-25-18)9-14(13)22/h2-9,21H,17-18H2,1H3,(H,19,23)/p+1/b15-10+,20-13+