(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-(acetamidomethyl)benzoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-(acetamidomethyl)benzoate Openeye Name: (1-butyltetrazol-5-yl)methyl 4-(acetamidomethyl)benzoate CAS Name: 4-(acetamidomethyl)benzoic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 4-(acetamidomethyl)benzoate Traditional Name: 4-(acetamidomethyl)benzoic acid (1-butyltetrazol-5-yl)methyl ester Formula: C16H21N5O3 MolecularWeight: 331.36964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC=C(C=C2)CNC(=O)C

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC=C(C=C2)CNC(=O)C

InChI

InChI=1S/C16H21N5O3/c1-3-4-9-21-15(18-19-20-21)11-24-16(23)14-7-5-13(6-8-14)10-17-12(2)22/h5-8H,3-4,9-11H2,1-2H3,(H,17,22)