4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid Openeye Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexanecarboxylic acid CAS Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid Traditional Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexanecarboxylic acid Formula: C15H20N4O2 MolecularWeight: 288.3449

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)O

Isomeric SMILES

CC1CCC(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)O

InChI

InChI=1S/C15H20N4O2/c1-9-3-4-10(15(20)21)7-12(9)19(2)14-11-5-6-16-13(11)17-8-18-14/h5-6,8-10,12H,3-4,7H2,1-2H3,(H,20,21)(H,16,17,18)