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

Systemtic Name: 1-(3-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(3-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(3-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(3-butoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(3-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=CC(=C1)C2C3=C(CCN2)C=C(C=C3)OCC

Isomeric SMILES

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

InChI

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