[3-[(4-fluorophenyl)methyl]phenyl]sulfanyl 2-azanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate

Systemtic Name: [3-[(4-fluorophenyl)methyl]phenyl]sulfanyl 2-azanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate Openeye Name: [3-[(4-fluorophenyl)methyl]phenyl]sulfanyl 2-amino-2-hydroxy-3-(4-methoxyphenyl)propanoate CAS Name: 2-amino-2-hydroxy-3-(4-methoxyphenyl)propanoic acid [[3-[(4-fluorophenyl)methyl]phenyl]thio] ester IUPAC Name: [3-[(4-fluorophenyl)methyl]phenyl]sulfanyl 2-amino-2-hydroxy-3-(4-methoxyphenyl)propanoate Traditional Name: 2-amino-2-hydroxy-3-(4-methoxyphenyl)propionic acid [[3-(4-fluorobenzyl)phenyl]thio] ester Formula: C23H22FNO4S MolecularWeight: 427.488483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OSC2=CC=CC(=C2)CC3=CC=C(C=C3)F)(N)O

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)OSC2=CC=CC(=C2)CC3=CC=C(C=C3)F)(N)O

InChI

InChI=1S/C23H22FNO4S/c1-28-20-11-7-17(8-12-20)15-23(25,27)22(26)29-30-21-4-2-3-18(14-21)13-16-5-9-19(24)10-6-16/h2-12,14,27H,13,15,25H2,1H3