ethyl (2R,3S)-2-(benzotriazol-1-yl)-2-ethoxy-3-(4-methylphenyl)-3-oxidanyl-propanoate

Systemtic Name: ethyl (2R,3S)-2-(benzotriazol-1-yl)-2-ethoxy-3-(4-methylphenyl)-3-oxidanyl-propanoate Openeye Name: ethyl (2R,3S)-2-(benzotriazol-1-yl)-2-ethoxy-3-hydroxy-3-(p-tolyl)propanoate CAS Name: (2R,3S)-2-(1-benzotriazolyl)-2-ethoxy-3-hydroxy-3-(4-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-(benzotriazol-1-yl)-2-ethoxy-3-hydroxy-3-(4-methylphenyl)propanoate Traditional Name: (2R,3S)-2-(benzotriazol-1-yl)-2-ethoxy-3-hydroxy-3-(p-tolyl)propionic acid ethyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)C)O)(N2C3=CC=CC=C3N=N2)OCC

Isomeric SMILES

CCOC(=O)[C@]([C@H](C1=CC=C(C=C1)C)O)(N2C3=CC=CC=C3N=N2)OCC

InChI

InChI=1S/C20H23N3O4/c1-4-26-19(25)20(27-5-2,18(24)15-12-10-14(3)11-13-15)23-17-9-7-6-8-16(17)21-22-23/h6-13,18,24H,4-5H2,1-3H3/t18-,20+/m0/s1