(2S)-2-[(4-tert-butylphenyl)amino]-2-(3-chlorophenyl)ethanoic acid

Systemtic Name: (2S)-2-[(4-tert-butylphenyl)amino]-2-(3-chlorophenyl)ethanoic acid Openeye Name: (2S)-2-(4-tert-butylanilino)-2-(3-chlorophenyl)acetic acid CAS Name: (2S)-2-(4-tert-butylanilino)-2-(3-chlorophenyl)acetic acid IUPAC Name: (2S)-2-(4-tert-butylanilino)-2-(3-chlorophenyl)acetic acid Traditional Name: (2S)-2-(4-tert-butylanilino)-2-(3-chlorophenyl)acetic acid Formula: C18H20ClNO2 MolecularWeight: 317.8099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClNO2/c1-18(2,3)13-7-9-15(10-8-13)20-16(17(21)22)12-5-4-6-14(19)11-12/h4-11,16,20H,1-3H3,(H,21,22)/t16-/m0/s1