azocan-1-yl-[(2S,4S)-4-(1-benzothiophen-3-yl)-2-(4-oxidanylbutoxy)-3,4-dihydro-2H-pyran-6-yl]methanone

Systemtic Name: azocan-1-yl-[(2S,4S)-4-(1-benzothiophen-3-yl)-2-(4-oxidanylbutoxy)-3,4-dihydro-2H-pyran-6-yl]methanone Openeye Name: azocan-1-yl-[(2S,4S)-4-(benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-yl]methanone CAS Name: 1-azocanyl-[(2S,4S)-4-(1-benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-yl]methanone IUPAC Name: azocan-1-yl-[(2S,4S)-4-(1-benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-yl]methanone Traditional Name: azocan-1-yl-[(2S,4S)-4-(benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-yl]methanone Formula: C25H33NO4S MolecularWeight: 443.59882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC(CC(O2)OCCCCO)C3=CSC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=C[C@H](C[C@H](O2)OCCCCO)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C25H33NO4S/c27-14-8-9-15-29-24-17-19(21-18-31-23-11-5-4-10-20(21)23)16-22(30-24)25(28)26-12-6-2-1-3-7-13-26/h4-5,10-11,16,18-19,24,27H,1-3,6-9,12-15,17H2/t19-,24+/m1/s1