2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(9-ethylcarbazol-3-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(9-ethylcarbazol-3-yl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(9-ethylcarbazol-3-yl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-1-iumyl]-N-(9-ethyl-3-carbazolyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(9-ethylcarbazol-3-yl)acetamide Traditional Name: N-(9-ethylcarbazol-3-yl)-2-(4-piperonylpiperazin-1-ium-1-yl)acetamide Formula: C28H31N4O3+ MolecularWeight: 471.57074

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C6=CC=CC=C61

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C6=CC=CC=C61

InChI

InChI=1S/C28H30N4O3/c1-2-32-24-6-4-3-5-22(24)23-16-21(8-9-25(23)32)29-28(33)18-31-13-11-30(12-14-31)17-20-7-10-26-27(15-20)35-19-34-26/h3-10,15-16H,2,11-14,17-19H2,1H3,(H,29,33)/p+1