4-tert-butyl-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-3-nitro-benzamide

Systemtic Name: 4-tert-butyl-N-[(4-morpholin-4-ylcarbonylphenyl)methyl]-3-nitro-benzamide Openeye Name: 4-tert-butyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-3-nitro-benzamide CAS Name: 4-tert-butyl-N-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-tert-butyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-tert-butyl-N-[4-(morpholine-4-carbonyl)benzyl]-3-nitro-benzamide Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O5/c1-23(2,3)19-9-8-18(14-20(19)26(29)30)21(27)24-15-16-4-6-17(7-5-16)22(28)25-10-12-31-13-11-25/h4-9,14H,10-13,15H2,1-3H3,(H,24,27)