1H-pyrazol-4-yl 2-[[4-(benzotriazol-1-ylmethoxy)phenyl]methyl]-3-ethoxy-propanoate

Systemtic Name: 1H-pyrazol-4-yl 2-[[4-(benzotriazol-1-ylmethoxy)phenyl]methyl]-3-ethoxy-propanoate Openeye Name: 1H-pyrazol-4-yl 2-[[4-(benzotriazol-1-ylmethoxy)phenyl]methyl]-3-ethoxy-propanoate CAS Name: 2-[[4-(1-benzotriazolylmethoxy)phenyl]methyl]-3-ethoxypropanoic acid 1H-pyrazol-4-yl ester IUPAC Name: 1H-pyrazol-4-yl 2-[[4-(benzotriazol-1-ylmethoxy)phenyl]methyl]-3-ethoxypropanoate Traditional Name: 2-[4-(benzotriazol-1-ylmethoxy)benzyl]-3-ethoxy-propionic acid 1H-pyrazol-4-yl ester Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CC1=CC=C(C=C1)OCN2C3=CC=CC=C3N=N2)C(=O)OC4=CNN=C4

Isomeric SMILES

CCOCC(CC1=CC=C(C=C1)OCN2C3=CC=CC=C3N=N2)C(=O)OC4=CNN=C4

InChI

InChI=1S/C22H23N5O4/c1-2-29-14-17(22(28)31-19-12-23-24-13-19)11-16-7-9-18(10-8-16)30-15-27-21-6-4-3-5-20(21)25-26-27/h3-10,12-13,17H,2,11,14-15H2,1H3,(H,23,24)