4-chloranyl-3-nitro-N-[4-nitro-2-[(4-propan-2-ylphenyl)methoxy]phenyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[4-nitro-2-[(4-propan-2-ylphenyl)methoxy]phenyl]benzamide Openeye Name: 4-chloro-N-[2-[(4-isopropylphenyl)methoxy]-4-nitro-phenyl]-3-nitro-benzamide CAS Name: 4-chloro-3-nitro-N-[4-nitro-2-[(4-propan-2-ylphenyl)methoxy]phenyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[4-nitro-2-[(4-propan-2-ylphenyl)methoxy]phenyl]benzamide Traditional Name: 4-chloro-N-[2-(4-isopropylbenzyl)oxy-4-nitro-phenyl]-3-nitro-benzamide Formula: C23H20ClN3O6 MolecularWeight: 469.8744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN3O6/c1-14(2)16-5-3-15(4-6-16)13-33-22-12-18(26(29)30)8-10-20(22)25-23(28)17-7-9-19(24)21(11-17)27(31)32/h3-12,14H,13H2,1-2H3,(H,25,28)