[2-oxidanylidene-2-[[(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl]amino]ethyl] 4-cyclohexylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl]amino]ethyl] 4-cyclohexylbenzoate Openeye Name: [2-[[(1R)-1-methyl-2-oxo-2-(propylamino)ethyl]amino]-2-oxo-ethyl] 4-cyclohexylbenzoate CAS Name: 4-cyclohexylbenzoic acid [2-oxo-2-[[(2R)-1-oxo-1-(propylamino)propan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2R)-1-oxo-1-(propylamino)propan-2-yl]amino]ethyl] 4-cyclohexylbenzoate Traditional Name: 4-cyclohexylbenzoic acid [2-keto-2-[[(1R)-2-keto-1-methyl-2-(propylamino)ethyl]amino]ethyl] ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)COC(=O)C1=CC=C(C=C1)C2CCCCC2

Isomeric SMILES

CCCNC(=O)[C@@H](C)NC(=O)COC(=O)C1=CC=C(C=C1)C2CCCCC2

InChI

InChI=1S/C21H30N2O4/c1-3-13-22-20(25)15(2)23-19(24)14-27-21(26)18-11-9-17(10-12-18)16-7-5-4-6-8-16/h9-12,15-16H,3-8,13-14H2,1-2H3,(H,22,25)(H,23,24)/t15-/m1/s1