N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]butan-2-amine

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]butan-2-amine Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]butan-2-amine CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-butanamine IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]butan-2-amine Traditional Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-sec-butyl-amine Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC2=C(C(=C1)Cl)OCCCO2

Isomeric SMILES

CCC(C)NCC1=CC2=C(C(=C1)Cl)OCCCO2

InChI

InChI=1S/C14H20ClNO2/c1-3-10(2)16-9-11-7-12(15)14-13(8-11)17-5-4-6-18-14/h7-8,10,16H,3-6,9H2,1-2H3