ethyl 2-[ethyl-[[4-[2-[2-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]amino]pyridine-3-carboxylate

Systemtic Name: ethyl 2-[ethyl-[[4-[2-[2-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]amino]pyridine-3-carboxylate Openeye Name: ethyl 2-[ethyl-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]amino]pyridine-3-carboxylate CAS Name: 2-[ethyl-[[4-[2-[2-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methyl]amino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[ethyl-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]amino]pyridine-3-carboxylate Traditional Name: 2-[ethyl-[4-[2-(2-trityltetrazol-5-yl)phenyl]benzyl]amino]nicotinic acid ethyl ester Formula: C43H38N6O2 MolecularWeight: 670.80082

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NN(N=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=C(C=CC=N7)C(=O)OCC

Isomeric SMILES

CCN(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NN(N=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=C(C=CC=N7)C(=O)OCC

InChI

InChI=1S/C43H38N6O2/c1-3-48(41-39(25-16-30-44-41)42(50)51-4-2)31-32-26-28-33(29-27-32)37-23-14-15-24-38(37)40-45-47-49(46-40)43(34-17-8-5-9-18-34,35-19-10-6-11-20-35)36-21-12-7-13-22-36/h5-30H,3-4,31H2,1-2H3