2-[1-(2-azanyl-4-phenyl-butanoyl)-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]-N-ethyl-2-(2-methylpropyl)nonanamide

Systemtic Name: 2-[1-(2-azanyl-4-phenyl-butanoyl)-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]-N-ethyl-2-(2-methylpropyl)nonanamide Openeye Name: 2-[1-(2-amino-4-phenyl-butanoyl)-2,5-dioxo-pyrrolidin-1-ium-1-yl]-N-ethyl-2-isobutyl-nonanamide CAS Name: 2-[1-(2-amino-1-oxo-4-phenylbutyl)-2,5-dioxo-1-pyrrolidin-1-iumyl]-N-ethyl-2-(2-methylpropyl)nonanamide IUPAC Name: 2-[1-(2-amino-4-phenylbutanoyl)-2,5-dioxopyrrolidin-1-ium-1-yl]-N-ethyl-2-(2-methylpropyl)nonanamide Traditional Name: 2-[1-(2-amino-4-phenyl-butanoyl)-2,5-diketo-pyrrolidin-1-ium-1-yl]-N-ethyl-2-isobutyl-pelargonamide Formula: C29H46N3O4+ MolecularWeight: 500.69324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC(C)C)(C(=O)NCC)[N+]1(C(=O)CCC1=O)C(=O)C(CCC2=CC=CC=C2)N

Isomeric SMILES

CCCCCCCC(CC(C)C)(C(=O)NCC)[N+]1(C(=O)CCC1=O)C(=O)C(CCC2=CC=CC=C2)N

InChI

InChI=1S/C29H45N3O4/c1-5-7-8-9-13-20-29(21-22(3)4,28(36)31-6-2)32(25(33)18-19-26(32)34)27(35)24(30)17-16-23-14-11-10-12-15-23/h10-12,14-15,22,24H,5-9,13,16-21,30H2,1-4H3/p+1