5-[(E)-prop-1-enyl]-1-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]pyrrole-2-carboxylic acid

Systemtic Name: 5-[(E)-prop-1-enyl]-1-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]pyrrole-2-carboxylic acid Openeye Name: 5-[(E)-prop-1-enyl]-1-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]pyrrole-2-carboxylic acid CAS Name: 5-[(E)-prop-1-enyl]-1-[[4-[2-[1-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methyl]-2-pyrrolecarboxylic acid IUPAC Name: 5-[(E)-prop-1-enyl]-1-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]pyrrole-2-carboxylic acid Traditional Name: 5-[(E)-prop-1-enyl]-1-[4-[2-(1-trityltetrazol-5-yl)phenyl]benzyl]pyrrole-2-carboxylic acid Formula: C41H33N5O2 MolecularWeight: 627.73302

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)O

Isomeric SMILES

C/C=C/C1=CC=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)O

InChI

InChI=1S/C41H33N5O2/c1-2-14-35-27-28-38(40(47)48)45(35)29-30-23-25-31(26-24-30)36-21-12-13-22-37(36)39-42-43-44-46(39)41(32-15-6-3-7-16-32,33-17-8-4-9-18-33)34-19-10-5-11-20-34/h2-28H,29H2,1H3,(H,47,48)/b14-2+