N-[4-(4-fluoranylphenoxy)butyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[4-(4-fluoranylphenoxy)butyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[4-(4-fluorophenoxy)butyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-(4-fluorophenoxy)butyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[4-(4-fluorophenoxy)butyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[4-(4-fluorophenoxy)butyl]-3-nitro-4-pyrrolidino-benzamide Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCCCCOC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCCCCOC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H24FN3O4/c22-17-6-8-18(9-7-17)29-14-4-1-11-23-21(26)16-5-10-19(20(15-16)25(27)28)24-12-2-3-13-24/h5-10,15H,1-4,11-14H2,(H,23,26)