[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)benzoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] 2-(furan-2-carbonylamino)benzoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]benzoic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(furan-2-carbonylamino)benzoate Traditional Name: 2-(2-furoylamino)benzoic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)C2=CC=CC=C2NC(=O)C3=CC=CO3

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)C2=CC=CC=C2NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H21N3O5/c22-14-21(10-4-1-5-11-21)24-18(25)13-29-20(27)15-7-2-3-8-16(15)23-19(26)17-9-6-12-28-17/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,23,26)(H,24,25)