[5-(dimethylaminomethyl)-2,2-dimethyl-oxan-4-yl] benzoate

Systemtic Name: [5-(dimethylaminomethyl)-2,2-dimethyl-oxan-4-yl] benzoate Openeye Name: [5-(dimethylaminomethyl)-2,2-dimethyl-tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [5-(dimethylaminomethyl)-2,2-dimethyl-4-oxanyl] ester IUPAC Name: [5-(dimethylaminomethyl)-2,2-dimethyloxan-4-yl] benzoate Traditional Name: benzoic acid [5-(dimethylaminomethyl)-2,2-dimethyl-tetrahydropyran-4-yl] ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(CO1)CN(C)C)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(C(CO1)CN(C)C)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C17H25NO3/c1-17(2)10-15(14(12-20-17)11-18(3)4)21-16(19)13-8-6-5-7-9-13/h5-9,14-15H,10-12H2,1-4H3