(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-(2,5-dimethylphenyl)carbonylbenzoate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-(2,5-dimethylphenyl)carbonylbenzoate Openeye Name: (1-propyltetrazol-5-yl)methyl 2-(2,5-dimethylbenzoyl)benzoate CAS Name: 2-[(2,5-dimethylphenyl)-oxomethyl]benzoic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 2-(2,5-dimethylbenzoyl)benzoate Traditional Name: 2-(2,5-dimethylbenzoyl)benzoic acid (1-propyltetrazol-5-yl)methyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC=CC=C2C(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC=CC=C2C(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H22N4O3/c1-4-11-25-19(22-23-24-25)13-28-21(27)17-8-6-5-7-16(17)20(26)18-12-14(2)9-10-15(18)3/h5-10,12H,4,11,13H2,1-3H3