4-acetamido-3-(4-azanylbutanoylamino)benzoic acid

Systemtic Name: 4-acetamido-3-(4-azanylbutanoylamino)benzoic acid Openeye Name: 4-acetamido-3-(4-aminobutanoylamino)benzoic acid CAS Name: 4-acetamido-3-[(4-amino-1-oxobutyl)amino]benzoic acid IUPAC Name: 4-acetamido-3-(4-aminobutanoylamino)benzoic acid Traditional Name: 4-acetamido-3-(4-aminobutanoylamino)benzoic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(=O)O)NC(=O)CCCN

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(=O)O)NC(=O)CCCN

InChI

InChI=1S/C13H17N3O4/c1-8(17)15-10-5-4-9(13(19)20)7-11(10)16-12(18)3-2-6-14/h4-5,7H,2-3,6,14H2,1H3,(H,15,17)(H,16,18)(H,19,20)