N-[3-(diethylamino)-2-oxidanyl-propyl]-6-nitro-1,2-benzoxazole-3-carboxamide

Systemtic Name: N-[3-(diethylamino)-2-oxidanyl-propyl]-6-nitro-1,2-benzoxazole-3-carboxamide Openeye Name: N-[3-(diethylamino)-2-hydroxy-propyl]-6-nitro-1,2-benzoxazole-3-carboxamide CAS Name: N-[3-(diethylamino)-2-hydroxypropyl]-6-nitro-1,2-benzoxazole-3-carboxamide IUPAC Name: N-[3-(diethylamino)-2-hydroxypropyl]-6-nitro-1,2-benzoxazole-3-carboxamide Traditional Name: N-[3-(diethylamino)-2-hydroxy-propyl]-6-nitro-indoxazene-3-carboxamide Formula: C15H20N4O5 MolecularWeight: 336.3431

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CNC(=O)C1=NOC2=C1C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCN(CC)CC(CNC(=O)C1=NOC2=C1C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H20N4O5/c1-3-18(4-2)9-11(20)8-16-15(21)14-12-6-5-10(19(22)23)7-13(12)24-17-14/h5-7,11,20H,3-4,8-9H2,1-2H3,(H,16,21)