N-(2-methoxyphenyl)-4-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(2-methoxyphenyl)-4-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(2-methoxyphenyl)-4-[[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(2-methoxyphenyl)-4-[[2-[4-(2-nitrophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-(2-methoxyphenyl)-4-[[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-(2-methoxyphenyl)-4-[[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H28N5O5+ MolecularWeight: 490.53102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C26H27N5O5/c1-36-24-9-5-2-6-21(24)28-26(33)19-10-12-20(13-11-19)27-25(32)18-29-14-16-30(17-15-29)22-7-3-4-8-23(22)31(34)35/h2-13H,14-18H2,1H3,(H,27,32)(H,28,33)/p+1