N-(4-benzamido-3-methyl-phenyl)-2-bromanyl-5-nitro-benzamide

Systemtic Name: N-(4-benzamido-3-methyl-phenyl)-2-bromanyl-5-nitro-benzamide Openeye Name: N-(4-benzamido-3-methyl-phenyl)-2-bromo-5-nitro-benzamide CAS Name: N-(4-benzamido-3-methylphenyl)-2-bromo-5-nitrobenzamide IUPAC Name: N-(4-benzamido-3-methylphenyl)-2-bromo-5-nitrobenzamide Traditional Name: N-(4-benzamido-3-methyl-phenyl)-2-bromo-5-nitro-benzamide Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Br)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Br)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H16BrN3O4/c1-13-11-15(7-10-19(13)24-20(26)14-5-3-2-4-6-14)23-21(27)17-12-16(25(28)29)8-9-18(17)22/h2-12H,1H3,(H,23,27)(H,24,26)