1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-methoxyphenoxy)ethanone

Systemtic Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-methoxyphenoxy)ethanone Openeye Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-methoxyphenoxy)ethanone CAS Name: 1-[4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazin-4-iumyl]-2-(4-methoxyphenoxy)ethanone IUPAC Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-methoxyphenoxy)ethanone Traditional Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-methoxyphenoxy)ethanone Formula: C28H32N3O3+ MolecularWeight: 458.57198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)COC4=CC=C(C=C4)OC)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)COC4=CC=C(C=C4)OC)C5=CC=CC=C51

InChI

InChI=1S/C28H31N3O3/c1-3-31-26-7-5-4-6-24(26)25-18-21(8-13-27(25)31)19-29-14-16-30(17-15-29)28(32)20-34-23-11-9-22(33-2)10-12-23/h4-13,18H,3,14-17,19-20H2,1-2H3/p+1