(3S,4S)-4-(azepan-1-ylcarbonyl)-3-(4-fluoranylphenoxy)-1-(phenylmethyl)azetidin-2-one

Systemtic Name: (3S,4S)-4-(azepan-1-ylcarbonyl)-3-(4-fluoranylphenoxy)-1-(phenylmethyl)azetidin-2-one Openeye Name: (3S,4S)-4-(azepane-1-carbonyl)-1-benzyl-3-(4-fluorophenoxy)azetidin-2-one CAS Name: (3S,4S)-4-[1-azepanyl(oxo)methyl]-3-(4-fluorophenoxy)-1-(phenylmethyl)-2-azetidinone IUPAC Name: (3S,4S)-4-(azepane-1-carbonyl)-1-benzyl-3-(4-fluorophenoxy)azetidin-2-one Traditional Name: (3S,4S)-4-(azepane-1-carbonyl)-1-benzyl-3-(4-fluorophenoxy)azetidin-2-one Formula: C23H25FN2O3 MolecularWeight: 396.454603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2C(C(=O)N2CC3=CC=CC=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

C1CCCN(CC1)C(=O)[C@@H]2[C@@H](C(=O)N2CC3=CC=CC=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN2O3/c24-18-10-12-19(13-11-18)29-21-20(22(27)25-14-6-1-2-7-15-25)26(23(21)28)16-17-8-4-3-5-9-17/h3-5,8-13,20-21H,1-2,6-7,14-16H2/t20-,21-/m0/s1