2-(2-benzamidopropanoylamino)-5-[bis(azanyl)methylideneamino]pentanoic acid

Systemtic Name: 2-(2-benzamidopropanoylamino)-5-[bis(azanyl)methylideneamino]pentanoic acid Openeye Name: 2-(2-benzamidopropanoylamino)-5-guanidino-pentanoic acid CAS Name: 2-[(2-benzamido-1-oxopropyl)amino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-(2-benzamidopropanoylamino)-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-(2-benzamidopropanoylamino)-5-guanidino-valeric acid Formula: C16H23N5O4 MolecularWeight: 349.38492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H23N5O4/c1-10(20-14(23)11-6-3-2-4-7-11)13(22)21-12(15(24)25)8-5-9-19-16(17)18/h2-4,6-7,10,12H,5,8-9H2,1H3,(H,20,23)(H,21,22)(H,24,25)(H4,17,18,19)