(2S)-6-(2-azanylethanoylamino)-2-benzamido-hexanoic acid

Systemtic Name: (2S)-6-(2-azanylethanoylamino)-2-benzamido-hexanoic acid Openeye Name: (2S)-6-[(2-aminoacetyl)amino]-2-benzamido-hexanoic acid CAS Name: (2S)-6-[(2-amino-1-oxoethyl)amino]-2-benzamidohexanoic acid IUPAC Name: (2S)-6-[(2-aminoacetyl)amino]-2-benzamidohexanoic acid Traditional Name: (2S)-2-benzamido-6-(glycylamino)hexanoic acid Formula: C15H21N3O4 MolecularWeight: 307.34494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCCCNC(=O)CN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N[C@@H](CCCCNC(=O)CN)C(=O)O

InChI

InChI=1S/C15H21N3O4/c16-10-13(19)17-9-5-4-8-12(15(21)22)18-14(20)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,16H2,(H,17,19)(H,18,20)(H,21,22)/t12-/m0/s1