1'-octylspiro[4H-isochromene-3,4'-piperidine]-1-one hydrochloride

Systemtic Name: 1'-octylspiro[4H-isochromene-3,4'-piperidine]-1-one hydrochloride Openeye Name: 1'-octylspiro[isochromane-3,4'-piperidine]-1-one hydrochloride CAS Name: 1'-octyl-1-spiro[3,4-dihydro-1H-2-benzopyran-3,4'-piperidine]one hydrochloride IUPAC Name: 1'-octylspiro[4H-isochromene-3,4'-piperidine]-1-one hydrochloride Traditional Name: 1'-octylspiro[isochroman-3,4'-piperidine]-1-one hydrochloride Formula: C21H32ClNO2 MolecularWeight: 365.93728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCC2(CC1)CC3=CC=CC=C3C(=O)O2.Cl

Isomeric SMILES

CCCCCCCCN1CCC2(CC1)CC3=CC=CC=C3C(=O)O2.Cl

InChI

InChI=1S/C21H31NO2.ClH/c1-2-3-4-5-6-9-14-22-15-12-21(13-16-22)17-18-10-7-8-11-19(18)20(23)24-21;/h7-8,10-11H,2-6,9,12-17H2,1H3;1H