N-(3-ethyl-2-morpholin-4-yl-pentyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(3-ethyl-2-morpholino-pentyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-ethyl-2-morpholin-4-ylpentyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-ethyl-2-morpholino-pentyl)-3-nitro-4-pyrrolidino-benzamide Formula: C22H34N4O4 MolecularWeight: 418.52976

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C22H34N4O4/c1-3-17(4-2)21(25-11-13-30-14-12-25)16-23-22(27)18-7-8-19(20(15-18)26(28)29)24-9-5-6-10-24/h7-8,15,17,21H,3-6,9-14,16H2,1-2H3,(H,23,27)