3-methoxy-1'-octyl-spiro[3,4-dihydroisochromene-1,3'-pyrrolidine]

Systemtic Name: 3-methoxy-1'-octyl-spiro[3,4-dihydroisochromene-1,3'-pyrrolidine] Openeye Name: 3-methoxy-1'-octyl-spiro[isochromane-1,3'-pyrrolidine] CAS Name: 3-methoxy-1'-octylspiro[3,4-dihydro-1H-2-benzopyran-1,3'-pyrrolidine] IUPAC Name: 3-methoxy-1'-octylspiro[3,4-dihydroisochromene-1,3'-pyrrolidine] Traditional Name: 3-methoxy-1'-octyl-spiro[isochroman-1,3'-pyrrolidine] Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCC2(C1)C3=CC=CC=C3CC(O2)OC

Isomeric SMILES

CCCCCCCCN1CCC2(C1)C3=CC=CC=C3CC(O2)OC

InChI

InChI=1S/C21H33NO2/c1-3-4-5-6-7-10-14-22-15-13-21(17-22)19-12-9-8-11-18(19)16-20(23-2)24-21/h8-9,11-12,20H,3-7,10,13-17H2,1-2H3