(phenylmethyl) 1-(2-azanyl-3-methyl-butanoyl)-1-[(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (phenylmethyl) 1-(2-azanyl-3-methyl-butanoyl)-1-[(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: benzyl 1-(2-amino-3-methyl-butanoyl)-1-[(1-methoxycarbonyl-3-methyl-butyl)carbamoyl]pyrrolidin-1-ium-2-carboxylate CAS Name: 1-(2-amino-3-methyl-1-oxobutyl)-1-[[(1-methoxy-4-methyl-1-oxopentan-2-yl)amino]-oxomethyl]-2-pyrrolidin-1-iumcarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(2-amino-3-methylbutanoyl)-1-[(1-methoxy-4-methyl-1-oxopentan-2-yl)carbamoyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: 1-(2-amino-3-methyl-butanoyl)-1-[(1-carbomethoxy-3-methyl-butyl)carbamoyl]pyrrolidin-1-ium-2-carboxylic acid benzyl ester Formula: C25H38N3O6+ MolecularWeight: 476.58572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)[N+]1(CCCC1C(=O)OCC2=CC=CC=C2)C(=O)C(C(C)C)N

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)[N+]1(CCCC1C(=O)OCC2=CC=CC=C2)C(=O)C(C(C)C)N

InChI

InChI=1S/C25H37N3O6/c1-16(2)14-19(23(30)33-5)27-25(32)28(22(29)21(26)17(3)4)13-9-12-20(28)24(31)34-15-18-10-7-6-8-11-18/h6-8,10-11,16-17,19-21H,9,12-15,26H2,1-5H3/p+1