ethyl 2,2-bis[5-(4-methylphenyl)-2-phenyl-1,2,4-triazol-3-yl]ethanoate

Systemtic Name: ethyl 2,2-bis[5-(4-methylphenyl)-2-phenyl-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2,2-bis[2-phenyl-5-(p-tolyl)-1,2,4-triazol-3-yl]acetate CAS Name: 2,2-bis[5-(4-methylphenyl)-2-phenyl-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2,2-bis[5-(4-methylphenyl)-2-phenyl-1,2,4-triazol-3-yl]acetate Traditional Name: 2,2-bis[2-phenyl-5-(p-tolyl)-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C34H30N6O2 MolecularWeight: 554.641

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)C)C4=NC(=NN4C5=CC=CC=C5)C6=CC=C(C=C6)C

Isomeric SMILES

CCOC(=O)C(C1=NC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)C)C4=NC(=NN4C5=CC=CC=C5)C6=CC=C(C=C6)C

InChI

InChI=1S/C34H30N6O2/c1-4-42-34(41)29(32-35-30(25-19-15-23(2)16-20-25)37-39(32)27-11-7-5-8-12-27)33-36-31(26-21-17-24(3)18-22-26)38-40(33)28-13-9-6-10-14-28/h5-22,29H,4H2,1-3H3