2-azanylpropanoyl 1-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-2-ethyl-cyclopentane-1-carboxylate

Systemtic Name: 2-azanylpropanoyl 1-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-2-ethyl-cyclopentane-1-carboxylate Openeye Name: 2-aminopropanoyl 1-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-2-ethyl-cyclopentanecarboxylate CAS Name: 1-[[2-acetamido-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-2-ethyl-1-cyclopentanecarboxylic acid (2-amino-1-oxopropyl) ester IUPAC Name: 2-aminopropanoyl 1-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-2-ethylcyclopentane-1-carboxylate Traditional Name: 1-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-2-ethyl-cyclopentanecarboxylic acid alanyl ester Formula: C22H31N3O6 MolecularWeight: 433.49804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC1(C(=O)OC(=O)C(C)N)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C

Isomeric SMILES

CCC1CCCC1(C(=O)OC(=O)C(C)N)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C

InChI

InChI=1S/C22H31N3O6/c1-4-16-6-5-11-22(16,21(30)31-20(29)13(2)23)25-19(28)18(24-14(3)26)12-15-7-9-17(27)10-8-15/h7-10,13,16,18,27H,4-6,11-12,23H2,1-3H3,(H,24,26)(H,25,28)