N-cyclopropyl-2-[4-[(1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]ethanamide; ethanedioic acid

Systemtic Name: N-cyclopropyl-2-[4-[(1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]ethanamide; ethanedioic acid Openeye Name: N-cyclopropyl-2-[4-[(1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]acetamide; oxalic acid CAS Name: N-cyclopropyl-2-[4-[(1-phenyl-4-pyrazolyl)methyl]-1-piperazinyl]acetamide; oxalic acid IUPAC Name: N-cyclopropyl-2-[4-[(1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]acetamide; oxalic acid Traditional Name: N-cyclopropyl-2-[4-[(1-phenylpyrazol-4-yl)methyl]piperazino]acetamide; oxalic acid Formula: C23H29N5O9 MolecularWeight: 519.50446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2CCN(CC2)CC3=CN(N=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC1NC(=O)CN2CCN(CC2)CC3=CN(N=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25N5O.2C2H2O4/c25-19(21-17-6-7-17)15-23-10-8-22(9-11-23)13-16-12-20-24(14-16)18-4-2-1-3-5-18;2*3-1(4)2(5)6/h1-5,12,14,17H,6-11,13,15H2,(H,21,25);2*(H,3,4)(H,5,6)