methyl 4-[[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]carbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]carbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(2-furylmethylamino)-2-oxo-ethyl]carbamoylamino]methyl]benzoate CAS Name: 4-[[[[[2-(2-furanylmethylamino)-2-oxoethyl]amino]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(furan-2-ylmethylamino)-2-oxoethyl]carbamoylamino]methyl]benzoate Traditional Name: 4-[[[2-(2-furfurylamino)-2-keto-ethyl]carbamoylamino]methyl]benzoic acid methyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC(=O)NCC2=CC=CO2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC(=O)NCC2=CC=CO2

InChI

InChI=1S/C17H19N3O5/c1-24-16(22)13-6-4-12(5-7-13)9-19-17(23)20-11-15(21)18-10-14-3-2-8-25-14/h2-8H,9-11H2,1H3,(H,18,21)(H2,19,20,23)