[2-oxidanylidene-3-(4-quinolin-1-ium-1-ylbutyl)-1,3-oxazolidin-5-yl]methyl N-heptadecylcarbamate

Systemtic Name: [2-oxidanylidene-3-(4-quinolin-1-ium-1-ylbutyl)-1,3-oxazolidin-5-yl]methyl N-heptadecylcarbamate Openeye Name: [2-oxo-3-(4-quinolin-1-ium-1-ylbutyl)oxazolidin-5-yl]methyl N-heptadecylcarbamate CAS Name: N-heptadecylcarbamic acid [2-oxo-3-[4-(1-quinolin-1-iumyl)butyl]-5-oxazolidinyl]methyl ester IUPAC Name: [2-oxo-3-(4-quinolin-1-ium-1-ylbutyl)-1,3-oxazolidin-5-yl]methyl N-heptadecylcarbamate Traditional Name: N-heptadecylcarbamic acid [2-keto-3-(4-quinolin-1-ium-1-ylbutyl)oxazolidin-5-yl]methyl ester Formula: C35H56N3O4+ MolecularWeight: 582.83684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC(=O)OCC1CN(C(=O)O1)CCCC[N+]2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC(=O)OCC1CN(C(=O)O1)CCCC[N+]2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C35H55N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-36-34(39)41-30-32-29-38(35(40)42-32)27-20-19-26-37-28-21-23-31-22-16-17-24-33(31)37/h16-17,21-24,28,32H,2-15,18-20,25-27,29-30H2,1H3/p+1