3-methyl-2-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methylamino]butanoic acid Openeye Name: 3-methyl-2-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methylamino]butanoic acid CAS Name: 3-methyl-2-[[4-[2-[1-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methylamino]butanoic acid IUPAC Name: 3-methyl-2-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methylamino]butanoic acid Traditional Name: 3-methyl-2-[[4-[2-(1-trityltetrazol-5-yl)phenyl]benzyl]amino]butyric acid Formula: C38H35N5O2 MolecularWeight: 593.7168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=CC=C(C=C1)C2=CC=CC=C2C3=NN=NN3C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=CC=C(C=C1)C2=CC=CC=C2C3=NN=NN3C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H35N5O2/c1-27(2)35(37(44)45)39-26-28-22-24-29(25-23-28)33-20-12-13-21-34(33)36-40-41-42-43(36)38(30-14-6-3-7-15-30,31-16-8-4-9-17-31)32-18-10-5-11-19-32/h3-25,27,35,39H,26H2,1-2H3,(H,44,45)