2,3-bis(oxidanyl)propyl-cyclohexyl-methyl-[4-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)oxy]butanoyl]azanium

Systemtic Name: 2,3-bis(oxidanyl)propyl-cyclohexyl-methyl-[4-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)oxy]butanoyl]azanium Openeye Name: cyclohexyl-(2,3-dihydroxypropyl)-methyl-[4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]butanoyl]ammonium CAS Name: cyclohexyl-(2,3-dihydroxypropyl)-methyl-[1-oxo-4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]butyl]ammonium IUPAC Name: cyclohexyl-(2,3-dihydroxypropyl)-methyl-[4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]butanoyl]azanium Traditional Name: cyclohexyl-glyceryl-[4-[(2-keto-3,4-dihydro-1H-quinolin-6-yl)oxy]butanoyl]-methyl-ammonium Formula: C23H35N2O5+ MolecularWeight: 419.5344

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CC(CO)O)(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

C[N+](CC(CO)O)(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C23H34N2O5/c1-25(15-19(27)16-26,18-6-3-2-4-7-18)23(29)8-5-13-30-20-10-11-21-17(14-20)9-12-22(28)24-21/h10-11,14,18-19,26-27H,2-9,12-13,15-16H2,1H3/p+1