[2-[2-(benzotriazol-1-ylmethyl)-3-ethanoyl-2H-1,3,4-oxadiazol-5-yl]-6-ethoxy-phenyl] ethanoate

Systemtic Name: [2-[2-(benzotriazol-1-ylmethyl)-3-ethanoyl-2H-1,3,4-oxadiazol-5-yl]-6-ethoxy-phenyl] ethanoate Openeye Name: [2-[3-acetyl-2-(benzotriazol-1-ylmethyl)-2H-1,3,4-oxadiazol-5-yl]-6-ethoxy-phenyl] acetate CAS Name: acetic acid [2-[3-acetyl-2-(1-benzotriazolylmethyl)-2H-1,3,4-oxadiazol-5-yl]-6-ethoxyphenyl] ester IUPAC Name: [2-[3-acetyl-2-(benzotriazol-1-ylmethyl)-2H-1,3,4-oxadiazol-5-yl]-6-ethoxyphenyl] acetate Traditional Name: acetic acid [2-[3-acetyl-2-(benzotriazol-1-ylmethyl)-2H-1,3,4-oxadiazol-5-yl]-6-ethoxy-phenyl] ester Formula: C21H21N5O5 MolecularWeight: 423.42194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OC(=O)C)C2=NN(C(O2)CN3C4=CC=CC=C4N=N3)C(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1OC(=O)C)C2=NN(C(O2)CN3C4=CC=CC=C4N=N3)C(=O)C

InChI

InChI=1S/C21H21N5O5/c1-4-29-18-11-7-8-15(20(18)30-14(3)28)21-23-26(13(2)27)19(31-21)12-25-17-10-6-5-9-16(17)22-24-25/h5-11,19H,4,12H2,1-3H3