2-[[2-(cyclohexylcarbonylamino)-4-methyl-pentanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-(cyclohexylcarbonylamino)-4-methyl-pentanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(cyclohexanecarbonylamino)-4-methyl-pentanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[cyclohexyl(oxo)methyl]amino]-4-methyl-1-oxopentyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-(cyclohexanecarbonylamino)-4-methylpentanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(cyclohexanecarbonylamino)-4-methyl-pentanoyl]amino]-3-phenyl-propionic acid Formula: C22H32N2O4 MolecularWeight: 388.50048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C2CCCCC2

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C2CCCCC2

InChI

InChI=1S/C22H32N2O4/c1-15(2)13-18(23-20(25)17-11-7-4-8-12-17)21(26)24-19(22(27)28)14-16-9-5-3-6-10-16/h3,5-6,9-10,15,17-19H,4,7-8,11-14H2,1-2H3,(H,23,25)(H,24,26)(H,27,28)