(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[(2-chlorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-3-methylbutanoic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-[(2-chlorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-chlorobenzoyl)amino]-3-methyl-butyric acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C25H32ClNO3 MolecularWeight: 429.97948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2Cl)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2Cl)C)C(C)(C)C

InChI

InChI=1S/C25H32ClNO3/c1-15(2)22(27-23(28)19-10-8-9-11-21(19)26)24(29)30-14-20-16(3)12-18(13-17(20)4)25(5,6)7/h8-13,15,22H,14H2,1-7H3,(H,27,28)