(2-ethoxynaphthalen-1-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (2-ethoxynaphthalen-1-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (2-ethoxy-1-naphthyl)methyl 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (2-ethoxy-1-naphthalenyl)methyl ester IUPAC Name: (2-ethoxynaphthalen-1-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (2-ethoxy-1-naphthyl)methyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)COC(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)COC(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C22H20N2O4S/c1-2-26-19-8-7-15-5-3-4-6-17(15)18(19)13-27-21(25)10-9-20-23-22(24-28-20)16-11-12-29-14-16/h3-8,11-12,14H,2,9-10,13H2,1H3