[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-[1-(4-nitrophenyl)-4-pyrazolyl]methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Traditional Name: [1-(4-nitrophenyl)pyrazol-4-yl]-(4-p-phenetylsulfonylpiperazino)methanone Formula: C22H23N5O6S MolecularWeight: 485.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O6S/c1-2-33-20-7-9-21(10-8-20)34(31,32)25-13-11-24(12-14-25)22(28)17-15-23-26(16-17)18-3-5-19(6-4-18)27(29)30/h3-10,15-16H,2,11-14H2,1H3