1-(azocan-1-yl)-3-[2-methoxy-4-[(thiophen-2-ylmethylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[(thiophen-2-ylmethylamino)methyl]phenoxy]propan-2-ol Openeye Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[(2-thienylmethylamino)methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azocanyl)-3-[2-methoxy-4-[(thiophen-2-ylmethylamino)methyl]phenoxy]-2-propanol IUPAC Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[(thiophen-2-ylmethylamino)methyl]phenoxy]propan-2-ol Traditional Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[(2-thenylamino)methyl]phenoxy]propan-2-ol Formula: C23H34N2O3S MolecularWeight: 418.59266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC2=CC=CS2)OCC(CN3CCCCCCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC2=CC=CS2)OCC(CN3CCCCCCC3)O

InChI

InChI=1S/C23H34N2O3S/c1-27-23-14-19(15-24-16-21-8-7-13-29-21)9-10-22(23)28-18-20(26)17-25-11-5-3-2-4-6-12-25/h7-10,13-14,20,24,26H,2-6,11-12,15-18H2,1H3