5-[ethyl-(phenylmethyl)amino]-1-[2-(4-fluoranylphenoxy)ethyl]azepan-2-one

Systemtic Name: 5-[ethyl-(phenylmethyl)amino]-1-[2-(4-fluoranylphenoxy)ethyl]azepan-2-one Openeye Name: 5-[benzyl(ethyl)amino]-1-[2-(4-fluorophenoxy)ethyl]azepan-2-one CAS Name: 5-[ethyl-(phenylmethyl)amino]-1-[2-(4-fluorophenoxy)ethyl]-2-azepanone IUPAC Name: 5-[benzyl(ethyl)amino]-1-[2-(4-fluorophenoxy)ethyl]azepan-2-one Traditional Name: 5-[benzyl(ethyl)amino]-1-[2-(4-fluorophenoxy)ethyl]azepan-2-one Formula: C23H29FN2O2 MolecularWeight: 384.486963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2CCC(=O)N(CC2)CCOC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2CCC(=O)N(CC2)CCOC3=CC=C(C=C3)F

InChI

InChI=1S/C23H29FN2O2/c1-2-25(18-19-6-4-3-5-7-19)21-10-13-23(27)26(15-14-21)16-17-28-22-11-8-20(24)9-12-22/h3-9,11-12,21H,2,10,13-18H2,1H3