N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-2,3-dimethyl-cyclohexan-1-amine

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-2,3-dimethyl-cyclohexan-1-amine Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-2,3-dimethyl-cyclohexanamine CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-2,3-dimethyl-1-cyclohexanamine IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-2,3-dimethylcyclohexan-1-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl-(2,3-dimethylcyclohexyl)amine Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NCC2=C3C(=CC=C2)OCCCO3

Isomeric SMILES

CC1CCCC(C1C)NCC2=C3C(=CC=C2)OCCCO3

InChI

InChI=1S/C18H27NO2/c1-13-6-3-8-16(14(13)2)19-12-15-7-4-9-17-18(15)21-11-5-10-20-17/h4,7,9,13-14,16,19H,3,5-6,8,10-12H2,1-2H3