4-bromanyl-N-(4-morpholin-4-ylphenyl)-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-(4-morpholin-4-ylphenyl)-3-nitro-benzamide Openeye Name: 4-bromo-N-(4-morpholinophenyl)-3-nitro-benzamide CAS Name: 4-bromo-N-[4-(4-morpholinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-(4-morpholin-4-ylphenyl)-3-nitrobenzamide Traditional Name: 4-bromo-N-(4-morpholinophenyl)-3-nitro-benzamide Formula: C17H16BrN3O4 MolecularWeight: 406.23064

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H16BrN3O4/c18-15-6-1-12(11-16(15)21(23)24)17(22)19-13-2-4-14(5-3-13)20-7-9-25-10-8-20/h1-6,11H,7-10H2,(H,19,22)