2-[[3-(cyclohexylcarbonylamino)-4-methyl-phenyl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3-(cyclohexylcarbonylamino)-4-methyl-phenyl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[3-(cyclohexanecarbonylamino)-4-methyl-benzoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[3-[[cyclohexyl(oxo)methyl]amino]-4-methylphenyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[3-(cyclohexanecarbonylamino)-4-methylbenzoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[3-(cyclohexanecarbonylamino)-4-methyl-benzoyl]amino]-4-methyl-valeric acid Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O4/c1-13(2)11-18(21(26)27)23-20(25)16-10-9-14(3)17(12-16)22-19(24)15-7-5-4-6-8-15/h9-10,12-13,15,18H,4-8,11H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)