3-[2-(aminomethyl)-6-ethoxy-phenoxy]azepan-2-one

Systemtic Name: 3-[2-(aminomethyl)-6-ethoxy-phenoxy]azepan-2-one Openeye Name: 3-[2-(aminomethyl)-6-ethoxy-phenoxy]azepan-2-one CAS Name: 3-[2-(aminomethyl)-6-ethoxyphenoxy]-2-azepanone IUPAC Name: 3-[2-(aminomethyl)-6-ethoxyphenoxy]azepan-2-one Traditional Name: 3-[2-(aminomethyl)-6-ethoxy-phenoxy]azepan-2-one Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OC2CCCCNC2=O)CN

Isomeric SMILES

CCOC1=CC=CC(=C1OC2CCCCNC2=O)CN

InChI

InChI=1S/C15H22N2O3/c1-2-19-12-8-5-6-11(10-16)14(12)20-13-7-3-4-9-17-15(13)18/h5-6,8,13H,2-4,7,9-10,16H2,1H3,(H,17,18)