(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl-bis(phenylmethyl)azanium

Systemtic Name: (6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(6-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]ammonium CAS Name: (6-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(6-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]azanium Traditional Name: dibenzyl-[(2-keto-6-nitro-1,3-benzoxazol-3-yl)methyl]ammonium Formula: C22H20N3O4+ MolecularWeight: 390.4119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)CN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)CN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C22H19N3O4/c26-22-24(20-12-11-19(25(27)28)13-21(20)29-22)16-23(14-17-7-3-1-4-8-17)15-18-9-5-2-6-10-18/h1-13H,14-16H2/p+1