methyl 5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pent-4-ynoxy-benzoate

Systemtic Name: methyl 5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pent-4-ynoxy-benzoate Openeye Name: methyl 5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pent-4-ynoxy-benzoate CAS Name: 5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pent-4-ynoxybenzoic acid methyl ester IUPAC Name: methyl 5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pent-4-ynoxybenzoate Traditional Name: 5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pent-4-ynoxy-benzoic acid methyl ester Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)C2=CC(=C(C=C2)OCCCC#C)C(=O)OC

Isomeric SMILES

CC1=NC(=NO1)C2=CC(=C(C=C2)OCCCC#C)C(=O)OC

InChI

InChI=1S/C16H16N2O4/c1-4-5-6-9-21-14-8-7-12(10-13(14)16(19)20-3)15-17-11(2)22-18-15/h1,7-8,10H,5-6,9H2,2-3H3