(4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N2O3/c1-16(2)27-24(29)26-14-19-8-10-20(11-9-19)23(28)30-15-22-17(3)12-21(13-18(22)4)25(5,6)7/h8-13,16H,14-15H2,1-7H3,(H2,26,27,29)