1-(4-butoxyphenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(4-butoxyphenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(4-butoxyphenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4-butoxyphenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4-butoxyphenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(4-butoxyphenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO3/c1-4-6-15-26-17-9-7-16(8-10-17)21-18-11-12-20(24-3)22(25-5-2)19(18)13-14-23-21/h7-12,21,23H,4-6,13-15H2,1-3H3