(2R)-1-(1H-indol-3-yl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propan-1-one

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propan-1-one Openeye Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]-1-propanone IUPAC Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one Traditional Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one Formula: C23H27N2O+ MolecularWeight: 347.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O/c1-17(23(26)21-16-24-22-10-6-5-9-20(21)22)25-13-11-19(12-14-25)15-18-7-3-2-4-8-18/h2-10,16-17,19,24H,11-15H2,1H3/p+1/t17-/m1/s1