1-(4-bromophenyl)sulfonyl-N-(3-phenylmethoxypropyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-(3-phenylmethoxypropyl)piperidine-3-carboxamide Openeye Name: N-(3-benzyloxypropyl)-1-(4-bromophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-(3-phenylmethoxypropyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-(3-phenylmethoxypropyl)piperidine-3-carboxamide Traditional Name: N-(3-benzoxypropyl)-1-brosyl-nipecotamide Formula: C22H27BrN2O4S MolecularWeight: 495.42978

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C22H27BrN2O4S/c23-20-9-11-21(12-10-20)30(27,28)25-14-4-8-19(16-25)22(26)24-13-5-15-29-17-18-6-2-1-3-7-18/h1-3,6-7,9-12,19H,4-5,8,13-17H2,(H,24,26)