phenacyl 3-(benzotriazol-1-yl)propanoate

Systemtic Name: phenacyl 3-(benzotriazol-1-yl)propanoate Openeye Name: phenacyl 3-(benzotriazol-1-yl)propanoate CAS Name: 3-(1-benzotriazolyl)propanoic acid phenacyl ester IUPAC Name: phenacyl 3-(benzotriazol-1-yl)propanoate Traditional Name: 3-(benzotriazol-1-yl)propionic acid phenacyl ester Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)CCN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)CCN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H15N3O3/c21-16(13-6-2-1-3-7-13)12-23-17(22)10-11-20-15-9-5-4-8-14(15)18-19-20/h1-9H,10-12H2