(3S)-1-[[4-(2-methylpropyl)phenyl]methyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-[[4-(2-methylpropyl)phenyl]methyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-amine Openeye Name: (3S)-1-[(4-isobutylphenyl)methyl]-N-(1-isopropylpiperidin-1-ium-4-yl)piperidin-1-ium-3-amine CAS Name: (3S)-1-[[4-(2-methylpropyl)phenyl]methyl]-N-(1-propan-2-yl-4-piperidin-1-iumyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-1-[[4-(2-methylpropyl)phenyl]methyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-amine Traditional Name: [(3S)-1-(4-isobutylbenzyl)piperidin-1-ium-3-yl]-(1-isopropylpiperidin-1-ium-4-yl)amine Formula: C24H43N3+2 MolecularWeight: 373.61832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C[NH+]2CCCC(C2)NC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C[NH+]2CCC[C@@H](C2)NC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C24H41N3/c1-19(2)16-21-7-9-22(10-8-21)17-26-13-5-6-24(18-26)25-23-11-14-27(15-12-23)20(3)4/h7-10,19-20,23-25H,5-6,11-18H2,1-4H3/p+2/t24-/m0/s1