[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone Formula: C26H28N3O+ MolecularWeight: 398.52002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O/c1-2-29-24-11-7-6-10-22(24)23-18-20(12-13-25(23)29)19-27-14-16-28(17-15-27)26(30)21-8-4-3-5-9-21/h3-13,18H,2,14-17,19H2,1H3/p+1