ethyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)OCC)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)OCC)C4=CC=CC=C41

InChI

InChI=1S/C22H27N3O2/c1-3-25-20-8-6-5-7-18(20)19-15-17(9-10-21(19)25)16-23-11-13-24(14-12-23)22(26)27-4-2/h5-10,15H,3-4,11-14,16H2,1-2H3/p+1