4-morpholin-4-yl-3-nitro-N-pentan-2-yl-benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-pentan-2-yl-benzamide Openeye Name: N-(1-methylbutyl)-4-morpholino-3-nitro-benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-pentan-2-ylbenzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-pentan-2-ylbenzamide Traditional Name: N-(1-methylbutyl)-4-morpholino-3-nitro-benzamide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)NC(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O4/c1-3-4-12(2)17-16(20)13-5-6-14(15(11-13)19(21)22)18-7-9-23-10-8-18/h5-6,11-12H,3-4,7-10H2,1-2H3,(H,17,20)