[4-[(2S)-3-carbazol-9-yl-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-[(2S)-3-carbazol-9-yl-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-(furan-2-yl)methanone Openeye Name: [4-[(2S)-3-carbazol-9-yl-2-hydroxy-propyl]piperazin-4-ium-1-yl]-(2-furyl)methanone CAS Name: [4-[(2S)-3-(9-carbazolyl)-2-hydroxypropyl]-1-piperazin-4-iumyl]-(2-furanyl)methanone IUPAC Name: [4-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]piperazin-4-ium-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[(2S)-3-carbazol-9-yl-2-hydroxy-propyl]piperazin-4-ium-1-yl]-(2-furyl)methanone Formula: C24H26N3O3+ MolecularWeight: 404.48154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(CN2C3=CC=CC=C3C4=CC=CC=C42)O)C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](CN2C3=CC=CC=C3C4=CC=CC=C42)O)C(=O)C5=CC=CO5

InChI

InChI=1S/C24H25N3O3/c28-18(16-25-11-13-26(14-12-25)24(29)23-10-5-15-30-23)17-27-21-8-3-1-6-19(21)20-7-2-4-9-22(20)27/h1-10,15,18,28H,11-14,16-17H2/p+1/t18-/m1/s1