6-[4-(2-methylpropoxy)phenyl]-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinoline

Systemtic Name: 6-[4-(2-methylpropoxy)phenyl]-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinoline Openeye Name: 6-(4-isobutoxyphenyl)-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinoline CAS Name: 6-[4-(2-methylpropoxy)phenyl]-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinoline IUPAC Name: 6-[4-(2-methylpropoxy)phenyl]-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinoline Traditional Name: 6-(4-isobutoxyphenyl)-2,3,6,7,8,9-hexahydro-[1,4]dioxin[2,3-g]isoquinoline Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C2C3=CC4=C(C=C3CCN2)OCCO4

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C2C3=CC4=C(C=C3CCN2)OCCO4

InChI

InChI=1S/C21H25NO3/c1-14(2)13-25-17-5-3-15(4-6-17)21-18-12-20-19(23-9-10-24-20)11-16(18)7-8-22-21/h3-6,11-12,14,21-22H,7-10,13H2,1-2H3