N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-methoxy-4-phenyl-phenoxy)ethanamine

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-methoxy-4-phenyl-phenoxy)ethanamine Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-methoxy-4-phenyl-phenoxy)ethanamine CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-methoxy-4-phenylphenoxy)ethanamine IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-methoxy-4-phenylphenoxy)ethanamine Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-(2-methoxy-4-phenyl-phenoxy)ethyl]amine Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC=CC=C2)OCCNCC3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC=CC=C2)OCCNC[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C24H25NO4/c1-26-24-15-19(18-7-3-2-4-8-18)11-12-22(24)27-14-13-25-16-20-17-28-21-9-5-6-10-23(21)29-20/h2-12,15,20,25H,13-14,16-17H2,1H3/t20-/m0/s1