1-(4-butoxyphenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(4-butoxyphenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(4-butoxyphenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4-butoxyphenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4-butoxyphenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(4-butoxyphenyl)-7-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=CC(=C(C=C3CCN2)OC)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC

InChI

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