2-[1-(3,6-dimethylpyrazin-2-yl)-4-(3-hydroxyphenyl)piperidin-4-yl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-[1-(3,6-dimethylpyrazin-2-yl)-4-(3-hydroxyphenyl)piperidin-4-yl]pyrimidine-5-carboxylic acid Openeye Name: 2-[1-(3,6-dimethylpyrazin-2-yl)-4-(3-hydroxyphenyl)-4-piperidyl]pyrimidine-5-carboxylic acid CAS Name: 2-[1-(3,6-dimethyl-2-pyrazinyl)-4-(3-hydroxyphenyl)-4-piperidinyl]-5-pyrimidinecarboxylic acid IUPAC Name: 2-[1-(3,6-dimethylpyrazin-2-yl)-4-(3-hydroxyphenyl)piperidin-4-yl]pyrimidine-5-carboxylic acid Traditional Name: 2-[1-(3,6-dimethylpyrazin-2-yl)-4-(3-hydroxyphenyl)-4-piperidyl]pyrimidine-5-carboxylic acid Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)N2CCC(CC2)(C3=CC(=CC=C3)O)C4=NC=C(C=N4)C(=O)O)C

Isomeric SMILES

CC1=CN=C(C(=N1)N2CCC(CC2)(C3=CC(=CC=C3)O)C4=NC=C(C=N4)C(=O)O)C

InChI

InChI=1S/C22H23N5O3/c1-14-11-23-15(2)19(26-14)27-8-6-22(7-9-27,17-4-3-5-18(28)10-17)21-24-12-16(13-25-21)20(29)30/h3-5,10-13,28H,6-9H2,1-2H3,(H,29,30)