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

Systemtic Name: 5-ethoxy-6-methoxy-1-(3-methoxy-4-phenethyloxy-phenyl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: 5-ethoxy-6-methoxy-1-(3-methoxy-4-phenethyloxy-phenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 5-ethoxy-6-methoxy-1-(3-methoxy-4-phenethyloxyphenyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 5-ethoxy-6-methoxy-1-(3-methoxy-4-phenethyloxyphenyl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: 5-ethoxy-6-methoxy-1-(3-methoxy-4-phenethyloxy-phenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC2=C1CCNC2C3=CC(=C(C=C3)OCCC4=CC=CC=C4)OC)OC

Isomeric SMILES

CCOC1=C(C=CC2=C1CCNC2C3=CC(=C(C=C3)OCCC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C27H31NO4/c1-4-31-27-22-14-16-28-26(21(22)11-13-24(27)29-2)20-10-12-23(25(18-20)30-3)32-17-15-19-8-6-5-7-9-19/h5-13,18,26,28H,4,14-17H2,1-3H3