methyl 2-[4-[3-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]propoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[3-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]propoxy]phenyl]ethanoate Openeye Name: methyl 2-[4-[3-(3-phenethyl-7-propyl-benzothiophen-6-yl)oxypropoxy]phenyl]acetate CAS Name: 2-[4-[3-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]propoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[3-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]propoxy]phenyl]acetate Traditional Name: 2-[4-[3-(3-phenethyl-7-propyl-benzothiophen-6-yl)oxypropoxy]phenyl]acetic acid methyl ester Formula: C31H34O4S MolecularWeight: 502.66426

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1SC=C2CCC3=CC=CC=C3)OCCCOC4=CC=C(C=C4)CC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC2=C1SC=C2CCC3=CC=CC=C3)OCCCOC4=CC=C(C=C4)CC(=O)OC

InChI

InChI=1S/C31H34O4S/c1-3-8-28-29(35-20-7-19-34-26-15-12-24(13-16-26)21-30(32)33-2)18-17-27-25(22-36-31(27)28)14-11-23-9-5-4-6-10-23/h4-6,9-10,12-13,15-18,22H,3,7-8,11,14,19-21H2,1-2H3