3-(2-ethoxyphenoxy)-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(2-ethoxyphenoxy)-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(2-ethoxyphenoxy)-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(2-ethoxyphenoxy)-1-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(2-ethoxyphenoxy)-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(2-ethoxyphenoxy)-1-[4-(2-nitrophenyl)sulfonylpiperazino]propan-1-one Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O7S/c1-2-30-18-8-4-5-9-19(18)31-16-11-21(25)22-12-14-23(15-13-22)32(28,29)20-10-6-3-7-17(20)24(26)27/h3-10H,2,11-16H2,1H3