2-chloranyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(2R)-2-morpholino-2-(p-tolyl)ethyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(2R)-2-(4-methylphenyl)-2-(4-morpholinyl)ethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(2R)-2-morpholino-2-(p-tolyl)ethyl]-4-nitro-benzamide Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)N3CCOCC3

InChI

InChI=1S/C20H22ClN3O4/c1-14-2-4-15(5-3-14)19(23-8-10-28-11-9-23)13-22-20(25)17-7-6-16(24(26)27)12-18(17)21/h2-7,12,19H,8-11,13H2,1H3,(H,22,25)/t19-/m0/s1