(4-prop-1-en-2-ylcyclohexen-1-yl)methyl 4-(2H-1,2,3,4-tetrazol-5-yl)benzoate

Systemtic Name: (4-prop-1-en-2-ylcyclohexen-1-yl)methyl 4-(2H-1,2,3,4-tetrazol-5-yl)benzoate Openeye Name: (4-isopropenylcyclohexen-1-yl)methyl 4-(2H-tetrazol-5-yl)benzoate CAS Name: 4-(2H-tetrazol-5-yl)benzoic acid [4-(1-methylethenyl)-1-cyclohexenyl]methyl ester IUPAC Name: (4-prop-1-en-2-ylcyclohexen-1-yl)methyl 4-(2H-tetrazol-5-yl)benzoate Traditional Name: 4-(2H-tetrazol-5-yl)benzoic acid (4-isopropenylcyclohexen-1-yl)methyl ester Formula: C18H20N4O2 MolecularWeight: 324.377

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(=CC1)COC(=O)C2=CC=C(C=C2)C3=NNN=N3

Isomeric SMILES

CC(=C)C1CCC(=CC1)COC(=O)C2=CC=C(C=C2)C3=NNN=N3

InChI

InChI=1S/C18H20N4O2/c1-12(2)14-5-3-13(4-6-14)11-24-18(23)16-9-7-15(8-10-16)17-19-21-22-20-17/h3,7-10,14H,1,4-6,11H2,2H3,(H,19,20,21,22)