(2,5-dimethylphenyl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2,5-dimethylphenyl)methyl 2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-(p-anisoylamino)butyric acid (2,5-dimethylbenzyl) ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C(C(C)C)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C(C(C)C)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C22H27NO4/c1-14(2)20(23-21(24)17-8-10-19(26-5)11-9-17)22(25)27-13-18-12-15(3)6-7-16(18)4/h6-12,14,20H,13H2,1-5H3,(H,23,24)