2-[2-[2-(cyclohexylcarbonylamino)phenyl]ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[2-(cyclohexylcarbonylamino)phenyl]ethanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[2-(cyclohexanecarbonylamino)phenyl]acetyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[2-[[cyclohexyl(oxo)methyl]amino]phenyl]-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[2-(cyclohexanecarbonylamino)phenyl]acetyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[2-(cyclohexanecarbonylamino)phenyl]acetyl]amino]-4-methyl-valeric acid Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CC=CC=C1NC(=O)C2CCCCC2

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CC1=CC=CC=C1NC(=O)C2CCCCC2

InChI

InChI=1S/C21H30N2O4/c1-14(2)12-18(21(26)27)22-19(24)13-16-10-6-7-11-17(16)23-20(25)15-8-4-3-5-9-15/h6-7,10-11,14-15,18H,3-5,8-9,12-13H2,1-2H3,(H,22,24)(H,23,25)(H,26,27)