(2,6-dimethoxyphenyl)-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2,6-dimethoxyphenyl)-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2,6-dimethoxyphenyl)-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (2,6-dimethoxyphenyl)-[4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2,6-dimethoxyphenyl)-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2,6-dimethoxyphenyl)-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]methanone 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)C4=C(C=CC=C4OC)OC)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)C4=C(C=CC=C4OC)OC)C5=CC=CC=C51

InChI

InChI=1S/C28H31N3O3/c1-4-31-23-9-6-5-8-21(23)22-18-20(12-13-24(22)31)19-29-14-16-30(17-15-29)28(32)27-25(33-2)10-7-11-26(27)34-3/h5-13,18H,4,14-17,19H2,1-3H3/p+1