[(2S)-2-[2-(benzotriazol-1-yl)pyrrol-1-yl]-2-phenyl-ethyl] ethanoate

Systemtic Name: [(2S)-2-[2-(benzotriazol-1-yl)pyrrol-1-yl]-2-phenyl-ethyl] ethanoate Openeye Name: [(2S)-2-[2-(benzotriazol-1-yl)pyrrol-1-yl]-2-phenyl-ethyl] acetate CAS Name: acetic acid [(2S)-2-[2-(1-benzotriazolyl)-1-pyrrolyl]-2-phenylethyl] ester IUPAC Name: [(2S)-2-[2-(benzotriazol-1-yl)pyrrol-1-yl]-2-phenylethyl] acetate Traditional Name: acetic acid [(2S)-2-[2-(benzotriazol-1-yl)pyrrol-1-yl]-2-phenyl-ethyl] ester Formula: C20H18N4O2 MolecularWeight: 346.38252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C1=CC=CC=C1)N2C=CC=C2N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(=O)OC[C@H](C1=CC=CC=C1)N2C=CC=C2N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H18N4O2/c1-15(25)26-14-19(16-8-3-2-4-9-16)23-13-7-12-20(23)24-18-11-6-5-10-17(18)21-22-24/h2-13,19H,14H2,1H3/t19-/m1/s1