(2R)-1-(1H-indol-3-yl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]propan-1-one

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]propan-1-one Openeye Name: (2R)-1-(1H-indol-3-yl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]-1-propanone IUPAC Name: (2R)-1-(1H-indol-3-yl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]propan-1-one Traditional Name: (2R)-1-(1H-indol-3-yl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]propan-1-one Formula: C23H29N3O2+2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CC[NH+](CC3)CCOC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CC[NH+](CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2/c1-18(23(27)21-17-24-22-10-6-5-9-20(21)22)26-13-11-25(12-14-26)15-16-28-19-7-3-2-4-8-19/h2-10,17-18,24H,11-16H2,1H3/p+2/t18-/m1/s1