3-[(3-ethoxy-4-methoxy-phenyl)methylamino]azepan-2-one

Systemtic Name: 3-[(3-ethoxy-4-methoxy-phenyl)methylamino]azepan-2-one Openeye Name: 3-[(3-ethoxy-4-methoxy-phenyl)methylamino]azepan-2-one CAS Name: 3-[(3-ethoxy-4-methoxyphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(3-ethoxy-4-methoxyphenyl)methylamino]azepan-2-one Traditional Name: 3-[(3-ethoxy-4-methoxy-benzyl)amino]azepan-2-one Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC2CCCCNC2=O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC2CCCCNC2=O)OC

InChI

InChI=1S/C16H24N2O3/c1-3-21-15-10-12(7-8-14(15)20-2)11-18-13-6-4-5-9-17-16(13)19/h7-8,10,13,18H,3-6,9,11H2,1-2H3,(H,17,19)