N-(2-methyl-2-morpholin-4-yl-butyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-butyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(2-methyl-2-morpholino-butyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-methyl-2-(4-morpholinyl)butyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2-methyl-2-morpholin-4-ylbutyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(2-methyl-2-morpholino-butyl)-3-nitro-4-pyrrolidino-benzamide Formula: C20H30N4O4 MolecularWeight: 390.4766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4O4/c1-3-20(2,23-10-12-28-13-11-23)15-21-19(25)16-6-7-17(18(14-16)24(26)27)22-8-4-5-9-22/h6-7,14H,3-5,8-13,15H2,1-2H3,(H,21,25)