methyl 4-[[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]cyclohexyl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]cyclohexyl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-[2-(cyclopropylamino)-2-oxo-ethyl]cyclohexanecarbonyl]amino]benzoate CAS Name: 4-[[[1-[2-(cyclopropylamino)-2-oxoethyl]cyclohexyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[2-(cyclopropylamino)-2-oxoethyl]cyclohexanecarbonyl]amino]benzoate Traditional Name: 4-[[1-[2-(cyclopropylamino)-2-keto-ethyl]cyclohexanecarbonyl]amino]benzoic acid methyl ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2(CCCCC2)CC(=O)NC3CC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2(CCCCC2)CC(=O)NC3CC3

InChI

InChI=1S/C20H26N2O4/c1-26-18(24)14-5-7-16(8-6-14)22-19(25)20(11-3-2-4-12-20)13-17(23)21-15-9-10-15/h5-8,15H,2-4,9-13H2,1H3,(H,21,23)(H,22,25)