3-[(3R)-1-[(1,2-dimethylindol-3-yl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: 3-[(3R)-1-[(1,2-dimethylindol-3-yl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide Openeye Name: 3-[(3R)-1-[(1,2-dimethylindol-3-yl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide CAS Name: 3-[(3R)-1-[(1,2-dimethyl-3-indolyl)methyl]-3-piperidin-1-iumyl]-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)propanamide IUPAC Name: 3-[(3R)-1-[(1,2-dimethylindol-3-yl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide Traditional Name: 3-[(3R)-1-[(1,2-dimethylindol-3-yl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propionamide Formula: C26H42N4O+2 MolecularWeight: 426.63788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C[NH+]3CCCC(C3)CCC(=O)N(C)C4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C[NH+]3CCC[C@@H](C3)CCC(=O)N(C)C4CC[NH+](CC4)C

InChI

InChI=1S/C26H40N4O/c1-20-24(23-9-5-6-10-25(23)28(20)3)19-30-15-7-8-21(18-30)11-12-26(31)29(4)22-13-16-27(2)17-14-22/h5-6,9-10,21-22H,7-8,11-19H2,1-4H3/p+2/t21-/m1/s1