N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholino-ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-[(2R)-2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholino-ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C22H27FN4O5 MolecularWeight: 446.471983

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)F)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)NC[C@@H](C2=CC=C(C=C2)F)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H27FN4O5/c1-31-11-8-24-19-7-4-17(14-20(19)27(29)30)22(28)25-15-21(26-9-12-32-13-10-26)16-2-5-18(23)6-3-16/h2-7,14,21,24H,8-13,15H2,1H3,(H,25,28)/t21-/m0/s1