2-[(2-aminophenyl)methyl-ethyl-amino]-1-(azepan-1-yl)ethanone

Systemtic Name: 2-[(2-aminophenyl)methyl-ethyl-amino]-1-(azepan-1-yl)ethanone Openeye Name: 2-[(2-aminophenyl)methyl-ethyl-amino]-1-(azepan-1-yl)ethanone CAS Name: 2-[(2-aminophenyl)methyl-ethylamino]-1-(1-azepanyl)ethanone IUPAC Name: 2-[(2-aminophenyl)methyl-ethylamino]-1-(azepan-1-yl)ethanone Traditional Name: 2-[(2-aminobenzyl)-ethyl-amino]-1-(azepan-1-yl)ethanone Formula: C17H27N3O MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1N)CC(=O)N2CCCCCC2

Isomeric SMILES

CCN(CC1=CC=CC=C1N)CC(=O)N2CCCCCC2

InChI

InChI=1S/C17H27N3O/c1-2-19(13-15-9-5-6-10-16(15)18)14-17(21)20-11-7-3-4-8-12-20/h5-6,9-10H,2-4,7-8,11-14,18H2,1H3