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

Systemtic Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde CAS Name: 4-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-3-nitro-benzaldehyde Formula: C19H21N3O7S MolecularWeight: 435.45094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21N3O7S/c1-28-18-6-4-15(12-19(18)29-2)30(26,27)21-9-7-20(8-10-21)16-5-3-14(13-23)11-17(16)22(24)25/h3-6,11-13H,7-10H2,1-2H3