(2S)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one

Systemtic Name: (2S)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one Openeye Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one CAS Name: (2S)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-1-(1H-indol-3-yl)-1-propanone IUPAC Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one Traditional Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

C[C@@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C19H23N3O2/c1-13(18(23)16-12-20-17-5-3-2-4-15(16)17)21-8-10-22(11-9-21)19(24)14-6-7-14/h2-5,12-14,20H,6-11H2,1H3/p+1/t13-/m0/s1