[4-phenyl-2-propyl-5-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl 1-ethylpyrrole-2-carboxylate

Systemtic Name: [4-phenyl-2-propyl-5-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl 1-ethylpyrrole-2-carboxylate Openeye Name: [4-phenyl-2-propyl-5-(2H-tetrazol-5-yl)phenyl]methyl 1-ethylpyrrole-2-carboxylate CAS Name: 1-ethyl-2-pyrrolecarboxylic acid [4-phenyl-2-propyl-5-(2H-tetrazol-5-yl)phenyl]methyl ester IUPAC Name: [4-phenyl-2-propyl-5-(2H-tetrazol-5-yl)phenyl]methyl 1-ethylpyrrole-2-carboxylate Traditional Name: 1-ethylpyrrole-2-carboxylic acid [4-phenyl-2-propyl-5-(2H-tetrazol-5-yl)benzyl] ester Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C(=C1)C2=CC=CC=C2)C3=NNN=N3)COC(=O)C4=CC=CN4CC

Isomeric SMILES

CCCC1=C(C=C(C(=C1)C2=CC=CC=C2)C3=NNN=N3)COC(=O)C4=CC=CN4CC

InChI

InChI=1S/C24H25N5O2/c1-3-9-18-14-20(17-10-6-5-7-11-17)21(23-25-27-28-26-23)15-19(18)16-31-24(30)22-12-8-13-29(22)4-2/h5-8,10-15H,3-4,9,16H2,1-2H3,(H,25,26,27,28)