(1R,2S)-1-(2,3-dihydro-1-benzothiophen-5-yl)-2-(4-phenylbutylamino)propan-1-ol

Systemtic Name: (1R,2S)-1-(2,3-dihydro-1-benzothiophen-5-yl)-2-(4-phenylbutylamino)propan-1-ol Openeye Name: (1R,2S)-1-(2,3-dihydrobenzothiophen-5-yl)-2-(4-phenylbutylamino)propan-1-ol CAS Name: (1R,2S)-1-(2,3-dihydro-1-benzothiophen-5-yl)-2-(4-phenylbutylamino)-1-propanol IUPAC Name: (1R,2S)-1-(2,3-dihydro-1-benzothiophen-5-yl)-2-(4-phenylbutylamino)propan-1-ol Traditional Name: (1R,2S)-1-(2,3-dihydrobenzothiophen-5-yl)-2-(4-phenylbutylamino)propan-1-ol Formula: C21H27NOS MolecularWeight: 341.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1)SCC2)O)NCCCCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]([C@@H](C1=CC2=C(C=C1)SCC2)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)19-10-11-20-18(15-19)12-14-24-20/h2-4,7-8,10-11,15-16,21-23H,5-6,9,12-14H2,1H3/t16-,21-/m0/s1