N-(3-morpholin-4-ium-4-ylpropyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-nitro-4-pyrrolidino-benzamide Formula: C18H27N4O4+ MolecularWeight: 363.43138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCCC[NH+]3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCCC[NH+]3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O4/c23-18(19-6-3-7-20-10-12-26-13-11-20)15-4-5-16(17(14-15)22(24)25)21-8-1-2-9-21/h4-5,14H,1-3,6-13H2,(H,19,23)/p+1