1-(4-methoxy-2-nitro-phenyl)-4-[2-methyl-5-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-(4-methoxy-2-nitro-phenyl)-4-[2-methyl-5-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperazine Openeye Name: 1-(4-methoxy-2-nitro-phenyl)-4-[2-methyl-5-(tetrazol-1-yl)phenyl]sulfonyl-piperazine CAS Name: 1-(4-methoxy-2-nitrophenyl)-4-[2-methyl-5-(1-tetrazolyl)phenyl]sulfonylpiperazine IUPAC Name: 1-(4-methoxy-2-nitrophenyl)-4-[2-methyl-5-(tetrazol-1-yl)phenyl]sulfonylpiperazine Traditional Name: 1-(4-methoxy-2-nitro-phenyl)-4-[2-methyl-5-(tetrazol-1-yl)phenyl]sulfonyl-piperazine Formula: C19H21N7O5S MolecularWeight: 459.47894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=NN=N2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=NN=N2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H21N7O5S/c1-14-3-4-15(25-13-20-21-22-25)11-19(14)32(29,30)24-9-7-23(8-10-24)17-6-5-16(31-2)12-18(17)26(27)28/h3-6,11-13H,7-10H2,1-2H3