1-(4-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(4-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(4-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(4-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C3=C(CCN2)C=C(C=C3)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C3=C(CCN2)C=C(C=C3)OCC

InChI

InChI=1S/C21H27NO2/c1-3-5-14-24-18-8-6-16(7-9-18)21-20-11-10-19(23-4-2)15-17(20)12-13-22-21/h6-11,15,21-22H,3-5,12-14H2,1-2H3