4-oxidanylidene-4-[[(2S)-1-oxidanylidene-3-phenyl-1-(prop-2-ynylamino)propan-2-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[(2S)-1-oxidanylidene-3-phenyl-1-(prop-2-ynylamino)propan-2-yl]amino]butanoic acid Openeye Name: 4-[[(1S)-1-benzyl-2-oxo-2-(prop-2-ynylamino)ethyl]amino]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[[(2S)-1-oxo-3-phenyl-1-(prop-2-ynylamino)propan-2-yl]amino]butanoic acid IUPAC Name: 4-oxo-4-[[(2S)-1-oxo-3-phenyl-1-(prop-2-ynylamino)propan-2-yl]amino]butanoic acid Traditional Name: 4-[[(1S)-1-benzyl-2-keto-2-(propargylamino)ethyl]amino]-4-keto-butyric acid Formula: C16H18N2O4 MolecularWeight: 302.32512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C(CC1=CC=CC=C1)NC(=O)CCC(=O)O

Isomeric SMILES

C#CCNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H18N2O4/c1-2-10-17-16(22)13(11-12-6-4-3-5-7-12)18-14(19)8-9-15(20)21/h1,3-7,13H,8-11H2,(H,17,22)(H,18,19)(H,20,21)/t13-/m0/s1