(2,3-dimethyl-1H-indol-5-yl)-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2,3-dimethyl-1H-indol-5-yl)-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2,3-dimethyl-1H-indol-5-yl)-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]methanone CAS Name: (2,3-dimethyl-1H-indol-5-yl)-[4-[[(2R)-2-oxolanyl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2,3-dimethyl-1H-indol-5-yl)-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2,3-dimethyl-1H-indol-5-yl)-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]methanone Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)N3CC[NH+](CC3)CC4CCCO4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)N3CC[NH+](CC3)C[C@H]4CCCO4)C

InChI

InChI=1S/C20H27N3O2/c1-14-15(2)21-19-6-5-16(12-18(14)19)20(24)23-9-7-22(8-10-23)13-17-4-3-11-25-17/h5-6,12,17,21H,3-4,7-11,13H2,1-2H3/p+1/t17-/m1/s1