N-[(1S)-1-(4-bromophenyl)ethyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[(1S)-1-(4-bromophenyl)ethyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[(1S)-1-(4-bromophenyl)ethyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[(1S)-1-(4-bromophenyl)ethyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[(1S)-1-(4-bromophenyl)ethyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[(1S)-1-(4-bromophenyl)ethyl]-2-morpholino-5-nitro-benzamide Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O4/c1-13(14-2-4-15(20)5-3-14)21-19(24)17-12-16(23(25)26)6-7-18(17)22-8-10-27-11-9-22/h2-7,12-13H,8-11H2,1H3,(H,21,24)/t13-/m0/s1