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

Systemtic Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-piperidin-1-yl-butanamide Openeye Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-(1-piperidyl)butanamide CAS Name: 4-[3-(1-hydroxyethyl)-4-nitrophenoxy]-N-(1-piperidinyl)butanamide IUPAC Name: 4-[3-(1-hydroxyethyl)-4-nitrophenoxy]-N-piperidin-1-ylbutanamide Traditional Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-piperidino-butyramide Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OCCCC(=O)NN2CCCCC2)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=C(C=CC(=C1)OCCCC(=O)NN2CCCCC2)[N+](=O)[O-])O

InChI

InChI=1S/C17H25N3O5/c1-13(21)15-12-14(7-8-16(15)20(23)24)25-11-5-6-17(22)18-19-9-3-2-4-10-19/h7-8,12-13,21H,2-6,9-11H2,1H3,(H,18,22)