2-oxidanylidenepropyl 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: 2-oxidanylidenepropyl 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: acetonyl 2-[[4-(2-furylmethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(2-furanylmethylamino)-3-nitrophenyl]sulfonylamino]acetic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-[[4-(furan-2-ylmethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(2-furfurylamino)-3-nitro-phenyl]sulfonylamino]acetic acid acetonyl ester Formula: C16H17N3O8S MolecularWeight: 411.38648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)COC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O8S/c1-11(20)10-27-16(21)9-18-28(24,25)13-4-5-14(15(7-13)19(22)23)17-8-12-3-2-6-26-12/h2-7,17-18H,8-10H2,1H3