6-methyl-2-(4-phenylpiperazin-1-yl)pyrimidine-4-carboxylate

Systemtic Name: 6-methyl-2-(4-phenylpiperazin-1-yl)pyrimidine-4-carboxylate Openeye Name: 6-methyl-2-(4-phenylpiperazin-1-yl)pyrimidine-4-carboxylate CAS Name: 6-methyl-2-(4-phenyl-1-piperazinyl)-4-pyrimidinecarboxylate IUPAC Name: 6-methyl-2-(4-phenylpiperazin-1-yl)pyrimidine-4-carboxylate Traditional Name: 6-methyl-2-(4-phenylpiperazino)pyrimidine-4-carboxylate Formula: C16H17N4O2- MolecularWeight: 297.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)[O-])N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)[O-])N2CCN(CC2)C3=CC=CC=C3

InChI

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