4-[(4-pyrazin-2-ylpiperazin-1-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(4-pyrazin-2-ylpiperazin-1-yl)carbonylamino]benzoic acid Openeye Name: 4-[(4-pyrazin-2-ylpiperazine-1-carbonyl)amino]benzoic acid CAS Name: 4-[[oxo-[4-(2-pyrazinyl)-1-piperazinyl]methyl]amino]benzoic acid IUPAC Name: 4-[(4-pyrazin-2-ylpiperazine-1-carbonyl)amino]benzoic acid Traditional Name: 4-[(4-pyrazin-2-ylpiperazine-1-carbonyl)amino]benzoic acid Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H17N5O3/c22-15(23)12-1-3-13(4-2-12)19-16(24)21-9-7-20(8-10-21)14-11-17-5-6-18-14/h1-6,11H,7-10H2,(H,19,24)(H,22,23)