1-[4-[4-[ethoxy(dimethoxy)methyl]pyrazol-1-yl]phenyl]sulfonylpiperidine-4-carbaldehyde

Systemtic Name: 1-[4-[4-[ethoxy(dimethoxy)methyl]pyrazol-1-yl]phenyl]sulfonylpiperidine-4-carbaldehyde Openeye Name: 1-[4-[4-[ethoxy(dimethoxy)methyl]pyrazol-1-yl]phenyl]sulfonylpiperidine-4-carbaldehyde CAS Name: 1-[4-[4-[ethoxy(dimethoxy)methyl]-1-pyrazolyl]phenyl]sulfonyl-4-piperidinecarboxaldehyde IUPAC Name: 1-[4-[4-[ethoxy(dimethoxy)methyl]pyrazol-1-yl]phenyl]sulfonylpiperidine-4-carbaldehyde Traditional Name: 1-[4-[4-[ethoxy(dimethoxy)methyl]pyrazol-1-yl]phenyl]sulfonylisonipecotaldehyde Formula: C20H27N3O6S MolecularWeight: 437.50988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CN(N=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C=O)(OC)OC

Isomeric SMILES

CCOC(C1=CN(N=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C=O)(OC)OC

InChI

InChI=1S/C20H27N3O6S/c1-4-29-20(27-2,28-3)17-13-21-23(14-17)18-5-7-19(8-6-18)30(25,26)22-11-9-16(15-24)10-12-22/h5-8,13-16H,4,9-12H2,1-3H3