[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: (3-nitrophenyl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O6S/c1-2-28-17-6-8-18(9-7-17)29(26,27)21-12-10-20(11-13-21)19(23)15-4-3-5-16(14-15)22(24)25/h3-9,14H,2,10-13H2,1H3