ethyl (2S)-5-[bis(azanyl)methylideneamino]-2-(undecanoylamino)pentanoate; 5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: ethyl (2S)-5-[bis(azanyl)methylideneamino]-2-(undecanoylamino)pentanoate; 5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: ethyl (2S)-5-guanidino-2-(undecanoylamino)pentanoate; 5-oxopyrrolidine-2-carboxylic acid CAS Name: (2S)-5-(diaminomethylideneamino)-2-(1-oxoundecylamino)pentanoic acid ethyl ester; 5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: ethyl (2S)-5-(diaminomethylideneamino)-2-(undecanoylamino)pentanoate; 5-oxopyrrolidine-2-carboxylic acid Traditional Name: (2S)-5-guanidino-2-(undecanoylamino)valeric acid ethyl ester; pyroglutamic acid Formula: C24H45N5O6 MolecularWeight: 499.644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)OCC.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CCCCCCCCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)OCC.C1CC(=O)NC1C(=O)O

InChI

InChI=1S/C19H38N4O3.C5H7NO3/c1-3-5-6-7-8-9-10-11-14-17(24)23-16(18(25)26-4-2)13-12-15-22-19(20)21;7-4-2-1-3(6-4)5(8)9/h16H,3-15H2,1-2H3,(H,23,24)(H4,20,21,22);3H,1-2H2,(H,6,7)(H,8,9)/t16-;/m0./s1