(3-methylphenyl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (3-methylphenyl)methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: m-tolylmethyl 2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-(p-anisoylamino)butyric acid (3-methylbenzyl) ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO4/c1-14(2)19(21(24)26-13-16-7-5-6-15(3)12-16)22-20(23)17-8-10-18(25-4)11-9-17/h5-12,14,19H,13H2,1-4H3,(H,22,23)