3-[4-[1-(propylamino)ethyl]phenoxy]azepan-2-one

Systemtic Name: 3-[4-[1-(propylamino)ethyl]phenoxy]azepan-2-one Openeye Name: 3-[4-[1-(propylamino)ethyl]phenoxy]azepan-2-one CAS Name: 3-[4-[1-(propylamino)ethyl]phenoxy]-2-azepanone IUPAC Name: 3-[4-[1-(propylamino)ethyl]phenoxy]azepan-2-one Traditional Name: 3-[4-[1-(propylamino)ethyl]phenoxy]azepan-2-one Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C)C1=CC=C(C=C1)OC2CCCCNC2=O

Isomeric SMILES

CCCNC(C)C1=CC=C(C=C1)OC2CCCCNC2=O

InChI

InChI=1S/C17H26N2O2/c1-3-11-18-13(2)14-7-9-15(10-8-14)21-16-6-4-5-12-19-17(16)20/h7-10,13,16,18H,3-6,11-12H2,1-2H3,(H,19,20)