[2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl] heptanoate

Systemtic Name: [2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl] heptanoate Openeye Name: [2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)-4-piperidyl] heptanoate CAS Name: heptanoic acid [2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)-4-piperidinyl] ester IUPAC Name: [2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl] heptanoate Traditional Name: enanthic acid [2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)-4-piperidyl] ester Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1CC(N(C(C1)(C)CC)OC(C)C2=CC=CC=C2)(C)C

Isomeric SMILES

CCCCCCC(=O)OC1CC(N(C(C1)(C)CC)OC(C)C2=CC=CC=C2)(C)C

InChI

InChI=1S/C25H41NO3/c1-7-9-10-14-17-23(27)28-22-18-24(4,5)26(25(6,8-2)19-22)29-20(3)21-15-12-11-13-16-21/h11-13,15-16,20,22H,7-10,14,17-19H2,1-6H3