(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (1-butyltetrazol-5-yl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (1-butyltetrazol-5-yl)methyl ester Formula: C18H26N6O3 MolecularWeight: 374.43744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N6O3/c1-4-5-10-24-16(21-22-23-24)12-27-17(25)15-8-6-14(7-9-15)11-19-18(26)20-13(2)3/h6-9,13H,4-5,10-12H2,1-3H3,(H2,19,20,26)