(5-chloranyl-1-methyl-imidazol-2-yl)methyl 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 2-[[4-(2-furylmethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(2-furanylmethylamino)-3-nitrophenyl]sulfonylamino]acetic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 2-[[4-(furan-2-ylmethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(2-furfurylamino)-3-nitro-phenyl]sulfonylamino]acetic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C18H18ClN5O7S MolecularWeight: 483.88282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CO3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CO3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClN5O7S/c1-23-16(19)9-21-17(23)11-31-18(25)10-22-32(28,29)13-4-5-14(15(7-13)24(26)27)20-8-12-3-2-6-30-12/h2-7,9,20,22H,8,10-11H2,1H3