3-[4-(aminomethyl)phenoxy]azepan-2-one

Systemtic Name: 3-[4-(aminomethyl)phenoxy]azepan-2-one Openeye Name: 3-[4-(aminomethyl)phenoxy]azepan-2-one CAS Name: 3-[4-(aminomethyl)phenoxy]-2-azepanone IUPAC Name: 3-[4-(aminomethyl)phenoxy]azepan-2-one Traditional Name: 3-[4-(aminomethyl)phenoxy]azepan-2-one Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC2=CC=C(C=C2)CN

Isomeric SMILES

C1CCNC(=O)C(C1)OC2=CC=C(C=C2)CN

InChI

InChI=1S/C13H18N2O2/c14-9-10-4-6-11(7-5-10)17-12-3-1-2-8-15-13(12)16/h4-7,12H,1-3,8-9,14H2,(H,15,16)