2-methyl-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-methyl-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylic acid Openeye Name: 2-methyl-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylic acid CAS Name: 2-methyl-4-(4-phenyl-1-piperazinyl)-5-pyrimidinecarboxylic acid IUPAC Name: 2-methyl-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylic acid Traditional Name: 2-methyl-4-(4-phenylpiperazino)pyrimidine-5-carboxylic acid Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N2CCN(CC2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=NC=C(C(=N1)N2CCN(CC2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H18N4O2/c1-12-17-11-14(16(21)22)15(18-12)20-9-7-19(8-10-20)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3,(H,21,22)