2-(4-methoxy-3-nitro-phenyl)-1,3-bis(phenylmethyl)imidazolidine-1,3-diium

Systemtic Name: 2-(4-methoxy-3-nitro-phenyl)-1,3-bis(phenylmethyl)imidazolidine-1,3-diium Openeye Name: 1,3-dibenzyl-2-(4-methoxy-3-nitro-phenyl)imidazolidine-1,3-diium CAS Name: 2-(4-methoxy-3-nitrophenyl)-1,3-bis(phenylmethyl)imidazolidine-1,3-diium IUPAC Name: 1,3-dibenzyl-2-(4-methoxy-3-nitrophenyl)imidazolidine-1,3-diium Traditional Name: 1,3-dibenzyl-2-(4-methoxy-3-nitro-phenyl)imidazolidine-1,3-diium Formula: C24H27N3O3+2 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2[NH+](CC[NH+]2CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2[NH+](CC[NH+]2CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O3/c1-30-23-13-12-21(16-22(23)27(28)29)24-25(17-19-8-4-2-5-9-19)14-15-26(24)18-20-10-6-3-7-11-20/h2-13,16,24H,14-15,17-18H2,1H3/p+2