N-(cyclohexen-1-yl)-N-(2-methoxyethyl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-(2-methoxyethyl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-(2-methoxyethyl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(1-cyclohexenyl)-N-(2-methoxyethyl)-2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-(2-methoxyethyl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(cyclohexen-1-yl)-N-(2-methoxyethyl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Formula: C21H31N4O4+ MolecularWeight: 403.49524

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(C1=CCCCC1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COCCN(C1=CCCCC1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O4/c1-29-16-15-24(19-5-3-2-4-6-19)21(26)17-22-11-13-23(14-12-22)18-7-9-20(10-8-18)25(27)28/h5,7-10H,2-4,6,11-17H2,1H3/p+1