methyl 2-[(2-methylphenyl)methyl-(2-methylpropyl)carbamoyl]benzoate

Systemtic Name: methyl 2-[(2-methylphenyl)methyl-(2-methylpropyl)carbamoyl]benzoate Openeye Name: methyl 2-[isobutyl(o-tolylmethyl)carbamoyl]benzoate CAS Name: 2-[[(2-methylphenyl)methyl-(2-methylpropyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(2-methylphenyl)methyl-(2-methylpropyl)carbamoyl]benzoate Traditional Name: 2-[isobutyl-(2-methylbenzyl)carbamoyl]benzoic acid methyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC(C)C)C(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CN(CC(C)C)C(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C21H25NO3/c1-15(2)13-22(14-17-10-6-5-9-16(17)3)20(23)18-11-7-8-12-19(18)21(24)25-4/h5-12,15H,13-14H2,1-4H3