methyl 2-(2-methanoyl-4-methyl-phenyl)-5-(2-methylpropylcarbamoyl)benzoate

Systemtic Name: methyl 2-(2-methanoyl-4-methyl-phenyl)-5-(2-methylpropylcarbamoyl)benzoate Openeye Name: methyl 2-(2-formyl-4-methyl-phenyl)-5-(isobutylcarbamoyl)benzoate CAS Name: 2-(2-formyl-4-methylphenyl)-5-[(2-methylpropylamino)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-(2-formyl-4-methylphenyl)-5-(2-methylpropylcarbamoyl)benzoate Traditional Name: 2-(2-formyl-4-methyl-phenyl)-5-(isobutylcarbamoyl)benzoic acid methyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NCC(C)C)C(=O)OC)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NCC(C)C)C(=O)OC)C=O

InChI

InChI=1S/C21H23NO4/c1-13(2)11-22-20(24)15-6-8-18(19(10-15)21(25)26-4)17-7-5-14(3)9-16(17)12-23/h5-10,12-13H,11H2,1-4H3,(H,22,24)