[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-oxopropan-2-yl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid [2-(4-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-13(2)24-21(27)23-12-15-4-6-17(7-5-15)20(26)28-14(3)19(25)16-8-10-18(22)11-9-16/h4-11,13-14H,12H2,1-3H3,(H2,23,24,27)