methyl (2R)-2-[1-(benzotriazol-1-yl)isoindol-2-yl]propanoate

Systemtic Name: methyl (2R)-2-[1-(benzotriazol-1-yl)isoindol-2-yl]propanoate Openeye Name: methyl (2R)-2-[1-(benzotriazol-1-yl)isoindol-2-yl]propanoate CAS Name: (2R)-2-[1-(1-benzotriazolyl)-2-isoindolyl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[1-(benzotriazol-1-yl)isoindol-2-yl]propanoate Traditional Name: (2R)-2-[1-(benzotriazol-1-yl)isoindol-2-yl]propionic acid methyl ester Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1C=C2C=CC=CC2=C1N3C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@H](C(=O)OC)N1C=C2C=CC=CC2=C1N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H16N4O2/c1-12(18(23)24-2)21-11-13-7-3-4-8-14(13)17(21)22-16-10-6-5-9-15(16)19-20-22/h3-12H,1-2H3/t12-/m1/s1