(4-nitro-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl)-(phenylmethyl)azanium

Systemtic Name: (4-nitro-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl)-(phenylmethyl)azanium Openeye Name: benzyl-(4-nitro-7-oxo-cyclohepta-1,3,5-trien-1-yl)ammonium CAS Name: (4-nitro-7-oxo-1-cyclohepta-1,3,5-trienyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-(4-nitro-7-oxocyclohepta-1,3,5-trien-1-yl)azanium Traditional Name: benzyl-(7-keto-4-nitro-cyclohepta-1,3,5-trien-1-yl)ammonium Formula: C14H13N2O3+ MolecularWeight: 257.26462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C2=CC=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]C2=CC=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O3/c17-14-9-7-12(16(18)19)6-8-13(14)15-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,15,17)/p+1