[(3S,4R)-4-aminocarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] benzoate

Systemtic Name: [(3S,4R)-4-aminocarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] benzoate Openeye Name: [(3S,4R)-4-carbamoyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] benzoate CAS Name: benzoic acid [(3S,4R)-4-carbamoyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] ester IUPAC Name: [(3S,4R)-4-carbamoyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] benzoate Traditional Name: benzoic acid [(3S,4R)-4-carbamoyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CN1C2CCC1[C@H]([C@H](C2)OC(=O)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C16H20N2O3/c1-18-11-7-8-12(18)14(15(17)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H2,17,19)/t11?,12?,13-,14+/m0/s1