methyl 3-[(2S)-2-(benzotriazol-1-yl)-2-phenyl-ethanoyl]benzoate

Systemtic Name: methyl 3-[(2S)-2-(benzotriazol-1-yl)-2-phenyl-ethanoyl]benzoate Openeye Name: methyl 3-[(2S)-2-(benzotriazol-1-yl)-2-phenyl-acetyl]benzoate CAS Name: 3-[(2S)-2-(1-benzotriazolyl)-1-oxo-2-phenylethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2S)-2-(benzotriazol-1-yl)-2-phenylacetyl]benzoate Traditional Name: 3-[(2S)-2-(benzotriazol-1-yl)-2-phenyl-acetyl]benzoic acid methyl ester Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)C(C2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)[C@H](C2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H17N3O3/c1-28-22(27)17-11-7-10-16(14-17)21(26)20(15-8-3-2-4-9-15)25-19-13-6-5-12-18(19)23-24-25/h2-14,20H,1H3/t20-/m0/s1