4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde CAS Name: 4-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 3-nitro-4-(4-p-phenetylsulfonylpiperazino)benzaldehyde 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)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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