(4-propylpiperazin-4-ium-1-yl)-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone

Systemtic Name: (4-propylpiperazin-4-ium-1-yl)-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Openeye Name: (4-propylpiperazin-4-ium-1-yl)-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone CAS Name: (4-propyl-1-piperazin-4-iumyl)-[5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenyl]methanone IUPAC Name: (4-propylpiperazin-4-ium-1-yl)-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Traditional Name: (4-propylpiperazin-4-ium-1-yl)-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone Formula: C16H27N3OS+2 MolecularWeight: 309.47008

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CC=C(S2)C3CCC[NH2+]3

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CC=C(S2)[C@H]3CCC[NH2+]3

InChI

InChI=1S/C16H25N3OS/c1-2-8-18-9-11-19(12-10-18)16(20)15-6-5-14(21-15)13-4-3-7-17-13/h5-6,13,17H,2-4,7-12H2,1H3/p+2/t13-/m1/s1