[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(3-chloranyl-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(3-chloranyl-1-benzothiophen-2-yl)methanone Openeye Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidyl]-(3-chlorobenzothiophen-2-yl)methanone CAS Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]-(3-chloro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]-(3-chloro-1-benzothiophen-2-yl)methanone Traditional Name: [4-(4-bromophenyl)-4-hydroxy-piperidino]-(3-chlorobenzothiophen-2-yl)methanone Formula: C20H17BrClNO2S MolecularWeight: 450.77648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Br)O)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H17BrClNO2S/c21-14-7-5-13(6-8-14)20(25)9-11-23(12-10-20)19(24)18-17(22)15-3-1-2-4-16(15)26-18/h1-8,25H,9-12H2