azetidin-3-yl 3-[2-(1-benzothiophen-5-yl)ethoxy]-2-propanoyl-benzoate

Systemtic Name: azetidin-3-yl 3-[2-(1-benzothiophen-5-yl)ethoxy]-2-propanoyl-benzoate Openeye Name: azetidin-3-yl 3-[2-(benzothiophen-5-yl)ethoxy]-2-propanoyl-benzoate CAS Name: 3-[2-(1-benzothiophen-5-yl)ethoxy]-2-(1-oxopropyl)benzoic acid 3-azetidinyl ester IUPAC Name: azetidin-3-yl 3-[2-(1-benzothiophen-5-yl)ethoxy]-2-propanoylbenzoate Traditional Name: 3-[2-(benzothiophen-5-yl)ethoxy]-2-propionyl-benzoic acid azetidin-3-yl ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC=C1OCCC2=CC3=C(C=C2)SC=C3)C(=O)OC4CNC4

Isomeric SMILES

CCC(=O)C1=C(C=CC=C1OCCC2=CC3=C(C=C2)SC=C3)C(=O)OC4CNC4

InChI

InChI=1S/C23H23NO4S/c1-2-19(25)22-18(23(26)28-17-13-24-14-17)4-3-5-20(22)27-10-8-15-6-7-21-16(12-15)9-11-29-21/h3-7,9,11-12,17,24H,2,8,10,13-14H2,1H3