6-methyl-N-(3-methylbutyl)heptan-2-amine; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: 6-methyl-N-(3-methylbutyl)heptan-2-amine; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: N-isopentyl-6-methyl-heptan-2-amine; (2S)-5-oxopyrrolidine-2-carboxylic acid CAS Name: 6-methyl-N-(3-methylbutyl)-2-heptanamine; (2S)-5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: 6-methyl-N-(3-methylbutyl)heptan-2-amine; (2S)-5-oxopyrrolidine-2-carboxylic acid Traditional Name: 1,5-dimethylhexyl(isoamyl)amine; (2S)-5-ketoproline Formula: C18H36N2O3 MolecularWeight: 328.49004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NCCC(C)C.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CC(C)CCCC(C)NCCC(C)C.C1CC(=O)N[C@@H]1C(=O)O

InChI

InChI=1S/C13H29N.C5H7NO3/c1-11(2)7-6-8-13(5)14-10-9-12(3)4;7-4-2-1-3(6-4)5(8)9/h11-14H,6-10H2,1-5H3;3H,1-2H2,(H,6,7)(H,8,9)/t;3-/m.0/s1