[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] 2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-4-methylpentanoic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-[(4-chlorobenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(4-chlorobenzoyl)amino]-4-methyl-valeric acid [2-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H24ClN3O6 MolecularWeight: 449.88476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC(=O)NC(=O)NCC1=CC=CO1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(C(=O)OCC(=O)NC(=O)NCC1=CC=CO1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClN3O6/c1-13(2)10-17(24-19(27)14-5-7-15(22)8-6-14)20(28)31-12-18(26)25-21(29)23-11-16-4-3-9-30-16/h3-9,13,17H,10-12H2,1-2H3,(H,24,27)(H2,23,25,26,29)