2-chloranyl-N-[(2R)-2-(3-methoxyphenyl)-2-morpholin-4-yl-ethyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(2R)-2-(3-methoxyphenyl)-2-morpholin-4-yl-ethyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(2R)-2-(3-methoxyphenyl)-2-morpholino-ethyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(2R)-2-(3-methoxyphenyl)-2-(4-morpholinyl)ethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(2R)-2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(2R)-2-(3-methoxyphenyl)-2-morpholino-ethyl]-4-nitro-benzamide Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)N3CCOCC3

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)N3CCOCC3

InChI

InChI=1S/C20H22ClN3O5/c1-28-16-4-2-3-14(11-16)19(23-7-9-29-10-8-23)13-22-20(25)17-6-5-15(24(26)27)12-18(17)21/h2-6,11-12,19H,7-10,13H2,1H3,(H,22,25)/t19-/m0/s1