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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O3/c1-2-25-19-9-4-3-8-18(19)21-12-10-20(11-13-21)15-16-6-5-7-17(14-16)22(23)24/h3-9,14H,2,10-13,15H2,1H3/p+1