2-[(4-aminophenyl)-pentanoyl-amino]ethanoic acid

Systemtic Name: 2-[(4-aminophenyl)-pentanoyl-amino]ethanoic acid Openeye Name: 2-(4-amino-N-pentanoyl-anilino)acetic acid CAS Name: 2-[4-amino-N-(1-oxopentyl)anilino]acetic acid IUPAC Name: 2-(4-amino-N-pentanoylanilino)acetic acid Traditional Name: 2-(4-amino-N-valeryl-anilino)acetic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC(=O)O)C1=CC=C(C=C1)N

Isomeric SMILES

CCCCC(=O)N(CC(=O)O)C1=CC=C(C=C1)N

InChI

InChI=1S/C13H18N2O3/c1-2-3-4-12(16)15(9-13(17)18)11-7-5-10(14)6-8-11/h5-8H,2-4,9,14H2,1H3,(H,17,18)