(3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-yl) 4-methylbenzoate

Systemtic Name: (3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-yl) 4-methylbenzoate Openeye Name: (3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-yl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid (3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-yl) ester IUPAC Name: (3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-yl) ester Formula: C17H24N2O2 MolecularWeight: 288.38466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2C3CN(CC2CN(C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2C3CN(CC2CN(C3)C)C

InChI

InChI=1S/C17H24N2O2/c1-12-4-6-13(7-5-12)17(20)21-16-14-8-18(2)9-15(16)11-19(3)10-14/h4-7,14-16H,8-11H2,1-3H3