1-[(1R)-1-ethoxy-3-(4-nitrophenyl)prop-2-ynyl]benzotriazole

Systemtic Name: 1-[(1R)-1-ethoxy-3-(4-nitrophenyl)prop-2-ynyl]benzotriazole Openeye Name: 1-[(1R)-1-ethoxy-3-(4-nitrophenyl)prop-2-ynyl]benzotriazole CAS Name: 1-[(1R)-1-ethoxy-3-(4-nitrophenyl)prop-2-ynyl]benzotriazole IUPAC Name: 1-[(1R)-1-ethoxy-3-(4-nitrophenyl)prop-2-ynyl]benzotriazole Traditional Name: 1-[(1R)-1-ethoxy-3-(4-nitrophenyl)prop-2-ynyl]benzotriazole Formula: C17H14N4O3 MolecularWeight: 322.31806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C#CC1=CC=C(C=C1)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCO[C@H](C#CC1=CC=C(C=C1)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H14N4O3/c1-2-24-17(20-16-6-4-3-5-15(16)18-19-20)12-9-13-7-10-14(11-8-13)21(22)23/h3-8,10-11,17H,2H2,1H3/t17-/m1/s1