1-[(3-methoxyphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium Openeye Name: 1-[(3-methoxyphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium CAS Name: 1-[(3-methoxyphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium IUPAC Name: 1-[(3-methoxyphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium Traditional Name: 1-m-anisyl-4-(2-nitrobenzyl)piperazin-4-ium Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O3/c1-25-18-7-4-5-16(13-18)14-20-9-11-21(12-10-20)15-17-6-2-3-8-19(17)22(23)24/h2-8,13H,9-12,14-15H2,1H3/p+1