N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-(1-methylhexyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl(1-methylhexyl)amine Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCCCCC(C)NC1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C16H25NO2/c1-3-4-5-7-13(2)17-14-8-9-15-16(12-14)19-11-6-10-18-15/h8-9,12-13,17H,3-7,10-11H2,1-2H3