2,4-bis(4-methoxyphenyl)-5-oxidanidyl-3,1,5-benzoxadiazepin-5-ium

Systemtic Name: 2,4-bis(4-methoxyphenyl)-5-oxidanidyl-3,1,5-benzoxadiazepin-5-ium Openeye Name: 2,4-bis(4-methoxyphenyl)-5-oxido-3,1,5-benzoxadiazepin-5-ium CAS Name: 2,4-bis(4-methoxyphenyl)-5-oxido-3,1,5-benzoxadiazepin-5-ium IUPAC Name: 2,4-bis(4-methoxyphenyl)-5-oxido-3,1,5-benzoxadiazepin-5-ium Traditional Name: 2,4-bis(4-methoxyphenyl)-5-oxido-3,1,5-benzoxadiazepin-5-ium Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3[N+](=C(O2)C4=CC=C(C=C4)OC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3[N+](=C(O2)C4=CC=C(C=C4)OC)[O-]

InChI

InChI=1S/C22H18N2O4/c1-26-17-11-7-15(8-12-17)21-23-19-5-3-4-6-20(19)24(25)22(28-21)16-9-13-18(27-2)14-10-16/h3-14H,1-2H3