4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-morpholin-2-yl-butanamide

Systemtic Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-morpholin-2-yl-butanamide Openeye Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-morpholin-2-yl-butanamide CAS Name: 4-[3-(1-hydroxyethyl)-4-nitrophenoxy]-N-(2-morpholinyl)butanamide IUPAC Name: 4-[3-(1-hydroxyethyl)-4-nitrophenoxy]-N-morpholin-2-ylbutanamide Traditional Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-morpholin-2-yl-butyramide Formula: C16H23N3O6 MolecularWeight: 353.37032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OCCCC(=O)NC2CNCCO2)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=C(C=CC(=C1)OCCCC(=O)NC2CNCCO2)[N+](=O)[O-])O

InChI

InChI=1S/C16H23N3O6/c1-11(20)13-9-12(4-5-14(13)19(22)23)24-7-2-3-15(21)18-16-10-17-6-8-25-16/h4-5,9,11,16-17,20H,2-3,6-8,10H2,1H3,(H,18,21)