2-[3-(benzotriazol-2-yl)-4-methanoyl-phenyl]ethyl 2-methylbutanoate

Systemtic Name: 2-[3-(benzotriazol-2-yl)-4-methanoyl-phenyl]ethyl 2-methylbutanoate Openeye Name: 2-[3-(benzotriazol-2-yl)-4-formyl-phenyl]ethyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid 2-[3-(2-benzotriazolyl)-4-formylphenyl]ethyl ester IUPAC Name: 2-[3-(benzotriazol-2-yl)-4-formylphenyl]ethyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid 2-[3-(benzotriazol-2-yl)-4-formyl-phenyl]ethyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCCC1=CC(=C(C=C1)C=O)N2N=C3C=CC=CC3=N2

Isomeric SMILES

CCC(C)C(=O)OCCC1=CC(=C(C=C1)C=O)N2N=C3C=CC=CC3=N2

InChI

InChI=1S/C20H21N3O3/c1-3-14(2)20(25)26-11-10-15-8-9-16(13-24)19(12-15)23-21-17-6-4-5-7-18(17)22-23/h4-9,12-14H,3,10-11H2,1-2H3