3-[[4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[[4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[4-(4-methyl-1-piperazinyl)anilino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[[4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[[4-(4-methylpiperazino)phenyl]carbamoyl]pyrazinoic acid Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O

InChI

InChI=1S/C17H19N5O3/c1-21-8-10-22(11-9-21)13-4-2-12(3-5-13)20-16(23)14-15(17(24)25)19-7-6-18-14/h2-7H,8-11H2,1H3,(H,20,23)(H,24,25)