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

Systemtic Name: azocan-1-yl-[(2S,4S)-2-(4-oxidanylbutoxy)-4-thiophen-2-yl-3,4-dihydro-2H-pyran-6-yl]methanone Openeye Name: azocan-1-yl-[(2S,4S)-2-(4-hydroxybutoxy)-4-(2-thienyl)-3,4-dihydro-2H-pyran-6-yl]methanone CAS Name: 1-azocanyl-[(2S,4S)-2-(4-hydroxybutoxy)-4-thiophen-2-yl-3,4-dihydro-2H-pyran-6-yl]methanone IUPAC Name: azocan-1-yl-[(2S,4S)-2-(4-hydroxybutoxy)-4-thiophen-2-yl-3,4-dihydro-2H-pyran-6-yl]methanone Traditional Name: azocan-1-yl-[(2S,4S)-2-(4-hydroxybutoxy)-4-(2-thienyl)-3,4-dihydro-2H-pyran-6-yl]methanone Formula: C21H31NO4S MolecularWeight: 393.54014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC(CC(O2)OCCCCO)C3=CC=CS3

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=C[C@H](C[C@H](O2)OCCCCO)C3=CC=CS3

InChI

InChI=1S/C21H31NO4S/c23-12-6-7-13-25-20-16-17(19-9-8-14-27-19)15-18(26-20)21(24)22-10-4-2-1-3-5-11-22/h8-9,14-15,17,20,23H,1-7,10-13,16H2/t17-,20+/m1/s1