2-[(1R,3S)-3-azanyl-4-oxidanyl-1-phenyl-pentoxy]-4-chloranyl-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(1R,3S)-3-azanyl-4-oxidanyl-1-phenyl-pentoxy]-4-chloranyl-5-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(1R,3S)-3-amino-4-hydroxy-1-phenyl-pentoxy]-4-chloro-5-fluoro-benzonitrile CAS Name: 2-[(1R,3S)-3-amino-4-hydroxy-1-phenylpentoxy]-4-chloro-5-fluorobenzonitrile IUPAC Name: 2-[(1R,3S)-3-amino-4-hydroxy-1-phenylpentoxy]-4-chloro-5-fluorobenzonitrile Traditional Name: 2-[(1R,3S)-3-amino-4-hydroxy-1-phenyl-pentoxy]-4-chloro-5-fluoro-benzonitrile Formula: C18H18ClFN2O2 MolecularWeight: 348.799123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC(C1=CC=CC=C1)OC2=CC(=C(C=C2C#N)F)Cl)N)O

Isomeric SMILES

CC([C@H](C[C@H](C1=CC=CC=C1)OC2=CC(=C(C=C2C#N)F)Cl)N)O

InChI

InChI=1S/C18H18ClFN2O2/c1-11(23)16(22)9-18(12-5-3-2-4-6-12)24-17-8-14(19)15(20)7-13(17)10-21/h2-8,11,16,18,23H,9,22H2,1H3/t11?,16-,18+/m0/s1