[(3S)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [(3S)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: [(3S)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]-(3-methyl-2-thienyl)methanone CAS Name: [(3S)-1-(1H-indol-3-ylmethyl)-3-piperidin-1-iumyl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: [(3S)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]-(3-methylthiophen-2-yl)methanone Traditional Name: [(3S)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]-(3-methyl-2-thienyl)methanone Formula: C20H23N2OS+ MolecularWeight: 339.47442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCC[NH+](C2)CC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=C(SC=C1)C(=O)[C@H]2CCC[NH+](C2)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H22N2OS/c1-14-8-10-24-20(14)19(23)15-5-4-9-22(12-15)13-16-11-21-18-7-3-2-6-17(16)18/h2-3,6-8,10-11,15,21H,4-5,9,12-13H2,1H3/p+1/t15-/m0/s1