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

Systemtic Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-pyrrolidin-1-yl-butanamide Openeye Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-pyrrolidin-1-yl-butanamide CAS Name: 4-[3-(1-hydroxyethyl)-4-nitrophenoxy]-N-(1-pyrrolidinyl)butanamide IUPAC Name: 4-[3-(1-hydroxyethyl)-4-nitrophenoxy]-N-pyrrolidin-1-ylbutanamide Traditional Name: 4-[3-(1-hydroxyethyl)-4-nitro-phenoxy]-N-pyrrolidino-butyramide Formula: C16H23N3O5 MolecularWeight: 337.37092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OCCCC(=O)NN2CCCC2)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=C(C=CC(=C1)OCCCC(=O)NN2CCCC2)[N+](=O)[O-])O

InChI

InChI=1S/C16H23N3O5/c1-12(20)14-11-13(6-7-15(14)19(22)23)24-10-4-5-16(21)17-18-8-2-3-9-18/h6-7,11-12,20H,2-5,8-10H2,1H3,(H,17,21)