[(Z)-9-[(2,2-dimethylcyclopropyl)carbonylamino]-10-oxidanyl-10-oxidanylidene-dec-8-enyl]-dimethyl-(phenylmethyl)azanium

Systemtic Name: [(Z)-9-[(2,2-dimethylcyclopropyl)carbonylamino]-10-oxidanyl-10-oxidanylidene-dec-8-enyl]-dimethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(Z)-9-[(2,2-dimethylcyclopropanecarbonyl)amino]-10-hydroxy-10-oxo-dec-8-enyl]-dimethyl-ammonium CAS Name: [(Z)-9-[[(2,2-dimethylcyclopropyl)-oxomethyl]amino]-10-hydroxy-10-oxodec-8-enyl]-dimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(Z)-9-[(2,2-dimethylcyclopropanecarbonyl)amino]-10-hydroxy-10-oxodec-8-enyl]-dimethylazanium Traditional Name: benzyl-[(Z)-9-[(2,2-dimethylcyclopropanecarbonyl)amino]-10-hydroxy-10-keto-dec-8-enyl]-dimethyl-ammonium Formula: C25H39N2O3+ MolecularWeight: 415.58876

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1C(=O)NC(=CCCCCCCC[N+](C)(C)CC2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1(CC1C(=O)N/C(=C\CCCCCCC[N+](C)(C)CC2=CC=CC=C2)/C(=O)O)C

InChI

InChI=1S/C25H38N2O3/c1-25(2)18-21(25)23(28)26-22(24(29)30)16-12-7-5-6-8-13-17-27(3,4)19-20-14-10-9-11-15-20/h9-11,14-16,21H,5-8,12-13,17-19H2,1-4H3,(H-,26,28,29,30)/p+1/b22-16-