1-(2,3-dihydro-1-benzothiophen-6-yl)-2-(4-phenylbutylamino)propan-1-ol

Systemtic Name: 1-(2,3-dihydro-1-benzothiophen-6-yl)-2-(4-phenylbutylamino)propan-1-ol Openeye Name: 1-(2,3-dihydrobenzothiophen-6-yl)-2-(4-phenylbutylamino)propan-1-ol CAS Name: 1-(2,3-dihydro-1-benzothiophen-6-yl)-2-(4-phenylbutylamino)-1-propanol IUPAC Name: 1-(2,3-dihydro-1-benzothiophen-6-yl)-2-(4-phenylbutylamino)propan-1-ol Traditional Name: 1-(2,3-dihydrobenzothiophen-6-yl)-2-(4-phenylbutylamino)propan-1-ol Formula: C21H27NOS MolecularWeight: 341.51018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(CCS2)C=C1)O)NCCCCC3=CC=CC=C3

Isomeric SMILES

CC(C(C1=CC2=C(CCS2)C=C1)O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C21H27NOS/c1-16(22-13-6-5-9-17-7-3-2-4-8-17)21(23)19-11-10-18-12-14-24-20(18)15-19/h2-4,7-8,10-11,15-16,21-23H,5-6,9,12-14H2,1H3