2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]cyclohexanecarboxylic acid CAS Name: 2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]cyclohexanecarboxylic acid Formula: C21H29NO5 MolecularWeight: 375.45866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)C2CCCCC2C(=O)O

InChI

InChI=1S/C21H29NO5/c1-21(2,3)27-20(26)22-17(13-14-9-5-4-6-10-14)18(23)15-11-7-8-12-16(15)19(24)25/h4-6,9-10,15-17H,7-8,11-13H2,1-3H3,(H,22,26)(H,24,25)