2-methyl-2-[[4-[4-[(1-methylindazol-3-yl)carbonylamino]phenyl]cyclohexyl]carbonylamino]propanoic acid

Systemtic Name: 2-methyl-2-[[4-[4-[(1-methylindazol-3-yl)carbonylamino]phenyl]cyclohexyl]carbonylamino]propanoic acid Openeye Name: 2-methyl-2-[[4-[4-[(1-methylindazole-3-carbonyl)amino]phenyl]cyclohexanecarbonyl]amino]propanoic acid CAS Name: 2-methyl-2-[[[4-[4-[[(1-methyl-3-indazolyl)-oxomethyl]amino]phenyl]cyclohexyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[[4-[4-[(1-methylindazole-3-carbonyl)amino]phenyl]cyclohexanecarbonyl]amino]propanoic acid Traditional Name: 2-methyl-2-[[4-[4-[(1-methylindazole-3-carbonyl)amino]phenyl]cyclohexanecarbonyl]amino]propionic acid Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)C1CCC(CC1)C2=CC=C(C=C2)NC(=O)C3=NN(C4=CC=CC=C43)C

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1CCC(CC1)C2=CC=C(C=C2)NC(=O)C3=NN(C4=CC=CC=C43)C

InChI

InChI=1S/C26H30N4O4/c1-26(2,25(33)34)28-23(31)18-10-8-16(9-11-18)17-12-14-19(15-13-17)27-24(32)22-20-6-4-5-7-21(20)30(3)29-22/h4-7,12-16,18H,8-11H2,1-3H3,(H,27,32)(H,28,31)(H,33,34)