4-(2-methoxyphenyl)-2-piperazin-1-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(2-methoxyphenyl)-2-piperazin-1-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-(2-methoxyphenyl)-2-piperazin-1-yl-pyrimidine-5-carboxylic acid CAS Name: 4-(2-methoxyphenyl)-2-(1-piperazinyl)-5-pyrimidinecarboxylic acid IUPAC Name: 4-(2-methoxyphenyl)-2-piperazin-1-ylpyrimidine-5-carboxylic acid Traditional Name: 4-(2-methoxyphenyl)-2-piperazino-pyrimidine-5-carboxylic acid Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NC=C2C(=O)O)N3CCNCC3

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NC=C2C(=O)O)N3CCNCC3

InChI

InChI=1S/C16H18N4O3/c1-23-13-5-3-2-4-11(13)14-12(15(21)22)10-18-16(19-14)20-8-6-17-7-9-20/h2-5,10,17H,6-9H2,1H3,(H,21,22)