methyl 4-[[5-(3-cyclohexylpropanoylamino)-2-methyl-phenyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[5-(3-cyclohexylpropanoylamino)-2-methyl-phenyl]carbamoyl]benzoate Openeye Name: methyl 4-[[5-(3-cyclohexylpropanoylamino)-2-methyl-phenyl]carbamoyl]benzoate CAS Name: 4-[[5-[(3-cyclohexyl-1-oxopropyl)amino]-2-methylanilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(3-cyclohexylpropanoylamino)-2-methylphenyl]carbamoyl]benzoate Traditional Name: 4-[[5-(3-cyclohexylpropanoylamino)-2-methyl-phenyl]carbamoyl]benzoic acid methyl ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2CCCCC2)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2CCCCC2)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H30N2O4/c1-17-8-14-21(26-23(28)15-9-18-6-4-3-5-7-18)16-22(17)27-24(29)19-10-12-20(13-11-19)25(30)31-2/h8,10-14,16,18H,3-7,9,15H2,1-2H3,(H,26,28)(H,27,29)