3-methyl-N-[(2R)-3-methyl-2-morpholin-4-yl-butyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[(2R)-3-methyl-2-morpholin-4-yl-butyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[(2R)-3-methyl-2-morpholino-butyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[(2R)-3-methyl-2-(4-morpholinyl)butyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[(2R)-3-methyl-2-morpholino-butyl]-4-nitro-benzamide Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(C(C)C)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC[C@@H](C(C)C)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4/c1-12(2)16(19-6-8-24-9-7-19)11-18-17(21)14-4-5-15(20(22)23)13(3)10-14/h4-5,10,12,16H,6-9,11H2,1-3H3,(H,18,21)/t16-/m0/s1