(5-methyl-2-propan-2-yl-cyclohexyl) 4-[(2-chlorophenyl)carbonylcarbamoylamino]benzoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 4-[(2-chlorophenyl)carbonylcarbamoylamino]benzoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 4-[(2-chlorobenzoyl)carbamoylamino]benzoate CAS Name: 4-[[[[(2-chlorophenyl)-oxomethyl]amino]-oxomethyl]amino]benzoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 4-[(2-chlorobenzoyl)carbamoylamino]benzoate Traditional Name: 4-[(2-chlorobenzoyl)carbamoylamino]benzoic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C25H29ClN2O4 MolecularWeight: 456.96176

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC=C(C=C2)NC(=O)NC(=O)C3=CC=CC=C3Cl)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=CC=C(C=C2)NC(=O)NC(=O)C3=CC=CC=C3Cl)C(C)C

InChI

InChI=1S/C25H29ClN2O4/c1-15(2)19-13-8-16(3)14-22(19)32-24(30)17-9-11-18(12-10-17)27-25(31)28-23(29)20-6-4-5-7-21(20)26/h4-7,9-12,15-16,19,22H,8,13-14H2,1-3H3,(H2,27,28,29,31)