N-[[5-(4-bromophenyl)furan-2-yl]methyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[[5-(4-bromophenyl)-2-furanyl]methyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-1-esyl-isonipecotamide Formula: C19H23BrN2O4S MolecularWeight: 455.36592

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H23BrN2O4S/c1-2-27(24,25)22-11-9-15(10-12-22)19(23)21-13-17-7-8-18(26-17)14-3-5-16(20)6-4-14/h3-8,15H,2,9-13H2,1H3,(H,21,23)