[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 2-(cyclohexanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C22H32N2O6 MolecularWeight: 420.49928

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C=C1NC(=O)C2CCCCC2)OC)OC

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC(=C(C=C1NC(=O)C2CCCCC2)OC)OC

InChI

InChI=1S/C22H32N2O6/c1-5-11-23-20(25)14(2)30-22(27)16-12-18(28-3)19(29-4)13-17(16)24-21(26)15-9-7-6-8-10-15/h12-15H,5-11H2,1-4H3,(H,23,25)(H,24,26)/t14-/m0/s1