N-[2-(4-methylphenoxy)phenyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-methylphenoxy)phenyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-methylphenoxy)phenyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(4-methylphenoxy)phenyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(4-methylphenoxy)phenyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-methylphenoxy)phenyl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O4S/c1-21-11-13-24(14-12-21)33-26-10-6-5-9-25(26)28-27(30)23-15-18-29(19-16-23)34(31,32)20-17-22-7-3-2-4-8-22/h2-14,17,20,23H,15-16,18-19H2,1H3,(H,28,30)/b20-17+