butyl 4-[[(2S)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzoate

Systemtic Name: butyl 4-[[(2S)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzoate Openeye Name: butyl 4-[[(2S)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-(4-chlorophenyl)-3-methyl-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(2S)-2-(4-chlorophenyl)-3-methylbutanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzoic acid butyl ester Formula: C22H26ClNO3 MolecularWeight: 387.89974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=C(C=C2)Cl)C(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H](C2=CC=C(C=C2)Cl)C(C)C

InChI

InChI=1S/C22H26ClNO3/c1-4-5-14-27-22(26)17-8-12-19(13-9-17)24-21(25)20(15(2)3)16-6-10-18(23)11-7-16/h6-13,15,20H,4-5,14H2,1-3H3,(H,24,25)/t20-/m0/s1