4-nitro-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 4-nitro-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Openeye Name: 4-nitro-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide CAS Name: 4-nitro-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-nitro-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Traditional Name: 4-nitro-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Formula: C13H18N3O3+ MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c17-13(14-7-10-15-8-1-2-9-15)11-3-5-12(6-4-11)16(18)19/h3-6H,1-2,7-10H2,(H,14,17)/p+1