N-[(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: N-[(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: N-[(3-bromo-5-ethoxy-4-methoxy-phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: N-[(3-bromo-5-ethoxy-4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: N-[(3-bromo-5-ethoxy-4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: (3-bromo-5-ethoxy-4-methoxy-benzyl)-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C18H20BrNO4 MolecularWeight: 394.2597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)OCCO3)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)OCCO3)Br)OC

InChI

InChI=1S/C18H20BrNO4/c1-3-22-17-9-12(8-14(19)18(17)21-2)11-20-13-4-5-15-16(10-13)24-7-6-23-15/h4-5,8-10,20H,3,6-7,11H2,1-2H3