ethyl 4-[[2-(cyclohexylcarbonylamino)-3-methyl-pentanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(cyclohexylcarbonylamino)-3-methyl-pentanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-(cyclohexanecarbonylamino)-3-methyl-pentanoyl]amino]benzoate CAS Name: 4-[[2-[[cyclohexyl(oxo)methyl]amino]-3-methyl-1-oxopentyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(cyclohexanecarbonylamino)-3-methylpentanoyl]amino]benzoate Traditional Name: 4-[[2-(cyclohexanecarbonylamino)-3-methyl-pentanoyl]amino]benzoic acid ethyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)OCC)NC(=O)C2CCCCC2

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)OCC)NC(=O)C2CCCCC2

InChI

InChI=1S/C22H32N2O4/c1-4-15(3)19(24-20(25)16-9-7-6-8-10-16)21(26)23-18-13-11-17(12-14-18)22(27)28-5-2/h11-16,19H,4-10H2,1-3H3,(H,23,26)(H,24,25)