[4-[(2S)-3-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone

Systemtic Name: [4-[(2S)-3-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone Openeye Name: [4-[(2S)-3-(5-chloro-2-methyl-anilino)-2-hydroxy-propoxy]phenyl]-phenyl-methanone CAS Name: [4-[(2S)-3-(5-chloro-2-methylanilino)-2-hydroxypropoxy]phenyl]-phenylmethanone IUPAC Name: [4-[(2S)-3-(5-chloro-2-methylanilino)-2-hydroxypropoxy]phenyl]-phenylmethanone Traditional Name: [4-[(2S)-3-(5-chloro-2-methyl-anilino)-2-hydroxy-propoxy]phenyl]-phenyl-methanone Formula: C23H22ClNO3 MolecularWeight: 395.87868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NCC(COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC[C@@H](COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C23H22ClNO3/c1-16-7-10-19(24)13-22(16)25-14-20(26)15-28-21-11-8-18(9-12-21)23(27)17-5-3-2-4-6-17/h2-13,20,25-26H,14-15H2,1H3/t20-/m0/s1