dimethyl-[2-(octadecan-2-ylcarbamoyl)phenyl]-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium

Systemtic Name: dimethyl-[2-(octadecan-2-ylcarbamoyl)phenyl]-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium Openeye Name: dimethyl-[2-(1-methylheptadecylcarbamoyl)phenyl]-[(2-oxopyrrolidin-1-yl)methyl]ammonium CAS Name: dimethyl-[2-[(octadecan-2-ylamino)-oxomethyl]phenyl]-[(2-oxo-1-pyrrolidinyl)methyl]ammonium IUPAC Name: dimethyl-[2-(octadecan-2-ylcarbamoyl)phenyl]-[(2-oxopyrrolidin-1-yl)methyl]azanium Traditional Name: (2-ketopyrrolidino)methyl-dimethyl-[2-(1-methylheptadecylcarbamoyl)phenyl]ammonium Formula: C32H56N3O2+ MolecularWeight: 514.80594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)NC(=O)C1=CC=CC=C1[N+](C)(C)CN2CCCC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)NC(=O)C1=CC=CC=C1[N+](C)(C)CN2CCCC2=O

InChI

InChI=1S/C32H55N3O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28(2)33-32(37)29-23-19-20-24-30(29)35(3,4)27-34-26-21-25-31(34)36/h19-20,23-24,28H,5-18,21-22,25-27H2,1-4H3/p+1