(2S)-2-[4-(2-azanylethanoylamino)butanoylamino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: (2S)-2-[4-(2-azanylethanoylamino)butanoylamino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: (2S)-2-[4-[(2-aminoacetyl)amino]butanoylamino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: (2S)-2-[[4-[(2-amino-1-oxoethyl)amino]-1-oxobutyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2S)-2-[4-[(2-aminoacetyl)amino]butanoylamino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: (2S)-2-[4-(glycylamino)butanoylamino]-3-(4-hydroxyphenyl)propionic acid Formula: C15H21N3O5 MolecularWeight: 323.34434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)CCCNC(=O)CN)O

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)O)NC(=O)CCCNC(=O)CN)O

InChI

InChI=1S/C15H21N3O5/c16-9-14(21)17-7-1-2-13(20)18-12(15(22)23)8-10-3-5-11(19)6-4-10/h3-6,12,19H,1-2,7-9,16H2,(H,17,21)(H,18,20)(H,22,23)/t12-/m0/s1