(4-methoxy-1-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (4-methoxy-1-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-methoxy-1-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (4-methoxy-1-phenyl-3-pyrazolyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-methoxy-1-phenylpyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-methoxy-1-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H21N5O4 MolecularWeight: 407.42254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O4/c1-30-19-15-25(17-5-3-2-4-6-17)22-20(19)21(27)24-13-11-23(12-14-24)16-7-9-18(10-8-16)26(28)29/h2-10,15H,11-14H2,1H3