N-butyl-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-butyl-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-butyl-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-butyl-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-butyl-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-butyl-3-nitro-4-pyrrolidino-benzamide Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O3/c1-2-3-8-16-15(19)12-6-7-13(14(11-12)18(20)21)17-9-4-5-10-17/h6-7,11H,2-5,8-10H2,1H3,(H,16,19)