(Z)-2-[(2,2-dimethylcyclopropyl)carbonylamino]-10-(1-methylpiperazin-1-ium-1-yl)dec-2-enoic acid

Systemtic Name: (Z)-2-[(2,2-dimethylcyclopropyl)carbonylamino]-10-(1-methylpiperazin-1-ium-1-yl)dec-2-enoic acid Openeye Name: (Z)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-10-(1-methylpiperazin-1-ium-1-yl)dec-2-enoic acid CAS Name: (Z)-2-[[(2,2-dimethylcyclopropyl)-oxomethyl]amino]-10-(1-methyl-1-piperazin-1-iumyl)-2-decenoic acid IUPAC Name: (Z)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-10-(1-methylpiperazin-1-ium-1-yl)dec-2-enoic acid Traditional Name: (Z)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-10-(1-methylpiperazin-1-ium-1-yl)dec-2-enoic acid Formula: C21H38N3O3+ MolecularWeight: 380.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1C(=O)NC(=CCCCCCCC[N+]2(CCNCC2)C)C(=O)O)C

Isomeric SMILES

CC1(CC1C(=O)N/C(=C\CCCCCCC[N+]2(CCNCC2)C)/C(=O)O)C

InChI

InChI=1S/C21H37N3O3/c1-21(2)16-17(21)19(25)23-18(20(26)27)10-8-6-4-5-7-9-13-24(3)14-11-22-12-15-24/h10,17,22H,4-9,11-16H2,1-3H3,(H-,23,25,26,27)/p+1/b18-10-