N-(9-ethylcarbazol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(9-ethylcarbazol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(9-ethylcarbazol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(9-ethyl-3-carbazolyl)-2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(9-ethylcarbazol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(9-ethylcarbazol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Formula: C26H28N5O3+ MolecularWeight: 458.53222

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C51

InChI

InChI=1S/C26H27N5O3/c1-2-30-24-6-4-3-5-22(24)23-17-19(7-12-25(23)30)27-26(32)18-28-13-15-29(16-14-28)20-8-10-21(11-9-20)31(33)34/h3-12,17H,2,13-16,18H2,1H3,(H,27,32)/p+1