2-[2-(2-hydroxyethyloxy)ethylamino]-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[2-(2-hydroxyethyloxy)ethylamino]-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-[2-(2-hydroxyethoxy)ethylamino]-4-(3-nitroanilino)-4-oxo-butanoic acid CAS Name: 2-[2-(2-hydroxyethoxy)ethylamino]-4-(3-nitroanilino)-4-oxobutanoic acid IUPAC Name: 2-[2-(2-hydroxyethoxy)ethylamino]-4-(3-nitroanilino)-4-oxobutanoic acid Traditional Name: 2-[2-(2-hydroxyethoxy)ethylamino]-4-keto-4-(3-nitroanilino)butyric acid Formula: C14H19N3O7 MolecularWeight: 341.31656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CC(C(=O)O)NCCOCCO

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CC(C(=O)O)NCCOCCO

InChI

InChI=1S/C14H19N3O7/c18-5-7-24-6-4-15-12(14(20)21)9-13(19)16-10-2-1-3-11(8-10)17(22)23/h1-3,8,12,15,18H,4-7,9H2,(H,16,19)(H,20,21)