N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride

Systemtic Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride Openeye Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride CAS Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]methyl]-1-butanamine hydrochloride IUPAC Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride Traditional Name: butyl-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)benzyl]amine hydrochloride Formula: C20H26ClNO3 MolecularWeight: 363.87834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC=C(C=C1)OCC2=CC3=C(C=C2)OCCO3.Cl

Isomeric SMILES

CCCCNCC1=CC=C(C=C1)OCC2=CC3=C(C=C2)OCCO3.Cl

InChI

InChI=1S/C20H25NO3.ClH/c1-2-3-10-21-14-16-4-7-18(8-5-16)24-15-17-6-9-19-20(13-17)23-12-11-22-19;/h4-9,13,21H,2-3,10-12,14-15H2,1H3;1H