4-butoxy-N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]benzamide

Systemtic Name: 4-butoxy-N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]benzamide Openeye Name: 4-butoxy-N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]benzamide CAS Name: 4-butoxy-N-[[1-(4-ethoxyphenyl)-5-tetrazolyl]methyl]benzamide IUPAC Name: 4-butoxy-N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]benzamide Traditional Name: 4-butoxy-N-[(1-p-phenetyltetrazol-5-yl)methyl]benzamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC2=NN=NN2C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC2=NN=NN2C3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H25N5O3/c1-3-5-14-29-19-10-6-16(7-11-19)21(27)22-15-20-23-24-25-26(20)17-8-12-18(13-9-17)28-4-2/h6-13H,3-5,14-15H2,1-2H3,(H,22,27)