3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrrole-2-carboxamide

Systemtic Name: 3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrrole-2-carboxamide Openeye Name: 3,5-dimethyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1-(m-tolylmethyl)pyrrole-2-carboxamide CAS Name: 3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-2-pyrrolecarboxamide IUPAC Name: 3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrrole-2-carboxamide Traditional Name: 3,5-dimethyl-1-(3-methylbenzyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrrole-2-carboxamide Formula: C24H36N3O+ MolecularWeight: 382.56214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=C(C=C(N2CC3=CC=CC(=C3)C)C)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=C(C=C(N2CC3=CC=CC(=C3)C)C)C

InChI

InChI=1S/C24H35N3O/c1-18-9-7-11-22(15-18)17-27-21(4)16-19(2)23(27)24(28)25-12-8-14-26-13-6-5-10-20(26)3/h7,9,11,15-16,20H,5-6,8,10,12-14,17H2,1-4H3,(H,25,28)/p+1/t20-/m0/s1