2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperazin-1-yl)ethanamine

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperazin-1-yl)ethanamine Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperazin-1-yl)ethanamine CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methyl-1-piperazinyl)ethanamine IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperazin-1-yl)ethanamine Traditional Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperazino)ethyl]amine Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CN)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN1CCN(CC1)C(CN)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H25N3O2/c1-18-5-7-19(8-6-18)14(12-17)13-3-4-15-16(11-13)21-10-2-9-20-15/h3-4,11,14H,2,5-10,12,17H2,1H3