(4-ethoxy-3-methoxy-phenyl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-ethoxy-3-methoxy-phenyl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (4-ethoxy-3-methoxyphenyl)-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-ethoxy-3-methoxyphenyl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-ethoxy-3-methoxy-phenyl)-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-3-30-17-9-8-15(14-18(17)29-2)20(24)21-10-12-22(13-11-21)31(27,28)19-7-5-4-6-16(19)23(25)26/h4-9,14H,3,10-13H2,1-2H3