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

Systemtic Name: methyl 2-[3-[4-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]butoxy]phenyl]ethanoate Openeye Name: methyl 2-[3-[4-(3-phenethyl-7-propyl-benzothiophen-6-yl)oxybutoxy]phenyl]acetate CAS Name: 2-[3-[4-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]butoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[4-[(3-phenethyl-7-propyl-1-benzothiophen-6-yl)oxy]butoxy]phenyl]acetate Traditional Name: 2-[3-[4-(3-phenethyl-7-propyl-benzothiophen-6-yl)oxybutoxy]phenyl]acetic acid methyl ester Formula: C32H36O4S MolecularWeight: 516.69084

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1SC=C2CCC3=CC=CC=C3)OCCCCOC4=CC=CC(=C4)CC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC2=C1SC=C2CCC3=CC=CC=C3)OCCCCOC4=CC=CC(=C4)CC(=O)OC

InChI

InChI=1S/C32H36O4S/c1-3-10-29-30(18-17-28-26(23-37-32(28)29)16-15-24-11-5-4-6-12-24)36-20-8-7-19-35-27-14-9-13-25(21-27)22-31(33)34-2/h4-6,9,11-14,17-18,21,23H,3,7-8,10,15-16,19-20,22H2,1-2H3