[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate

Systemtic Name: [(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate Openeye Name: [(1S)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-anilino-4-oxo-furan-3-carboxylate CAS Name: 2-anilino-4-oxo-3-furancarboxylic acid [(2S)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl] 2-anilino-4-oxofuran-3-carboxylate Traditional Name: 2-anilino-4-keto-furan-3-carboxylic acid [(1S)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)N1CCCCCC1)OC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5/c1-14(19(24)22-11-7-2-3-8-12-22)27-20(25)17-16(23)13-26-18(17)21-15-9-5-4-6-10-15/h4-6,9-10,14,21H,2-3,7-8,11-13H2,1H3/t14-/m0/s1