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

Systemtic Name: (3-methoxyphenyl)-[4-[(3-nitrophenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-methoxyphenyl)-[4-[(3-nitrophenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-methoxyphenyl)-[4-[(3-nitrophenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-methoxyphenyl)-[4-[(3-nitrophenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-methoxyphenyl)-[4-(3-nitrobenzyl)piperazin-4-ium-1-yl]methanone Formula: C19H22N3O4+ MolecularWeight: 356.39568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4/c1-26-18-7-3-5-16(13-18)19(23)21-10-8-20(9-11-21)14-15-4-2-6-17(12-15)22(24)25/h2-7,12-13H,8-11,14H2,1H3/p+1