2-[4-(diethylamino)-2-oxidanyl-phenyl]carbonyl-6-nitro-benzoic acid

Systemtic Name: 2-[4-(diethylamino)-2-oxidanyl-phenyl]carbonyl-6-nitro-benzoic acid Openeye Name: 2-[4-(diethylamino)-2-hydroxy-benzoyl]-6-nitro-benzoic acid CAS Name: 2-[[4-(diethylamino)-2-hydroxyphenyl]-oxomethyl]-6-nitrobenzoic acid IUPAC Name: 2-[4-(diethylamino)-2-hydroxybenzoyl]-6-nitrobenzoic acid Traditional Name: 2-[4-(diethylamino)-2-hydroxy-benzoyl]-6-nitro-benzoic acid Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)O)O

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)O)O

InChI

InChI=1S/C18H18N2O6/c1-3-19(4-2)11-8-9-12(15(21)10-11)17(22)13-6-5-7-14(20(25)26)16(13)18(23)24/h5-10,21H,3-4H2,1-2H3,(H,23,24)