[2,2-dimethyl-5-(piperidin-1-ylmethyl)oxan-4-yl] benzoate

Systemtic Name: [2,2-dimethyl-5-(piperidin-1-ylmethyl)oxan-4-yl] benzoate Openeye Name: [2,2-dimethyl-5-(1-piperidylmethyl)tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [2,2-dimethyl-5-(1-piperidinylmethyl)-4-oxanyl] ester IUPAC Name: [2,2-dimethyl-5-(piperidin-1-ylmethyl)oxan-4-yl] benzoate Traditional Name: benzoic acid [2,2-dimethyl-5-(piperidinomethyl)tetrahydropyran-4-yl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(CO1)CN2CCCCC2)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(C(CO1)CN2CCCCC2)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H29NO3/c1-20(2)13-18(24-19(22)16-9-5-3-6-10-16)17(15-23-20)14-21-11-7-4-8-12-21/h3,5-6,9-10,17-18H,4,7-8,11-15H2,1-2H3