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

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[(3-methoxyphenyl)methyl]-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[(3-methoxyphenyl)methyl]-N-(4-nitrophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(3-methoxyphenyl)methyl]-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-m-anisyl-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Formula: C19H23N4O4+ MolecularWeight: 371.41032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-27-18-4-2-3-15(13-18)14-21-9-11-22(12-10-21)19(24)20-16-5-7-17(8-6-16)23(25)26/h2-8,13H,9-12,14H2,1H3,(H,20,24)/p+1