3-benzamido-4-methyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]benzamide

Systemtic Name: 3-benzamido-4-methyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]benzamide Openeye Name: 3-benzamido-N-[(2-hydroxy-5-nitro-phenyl)methyl]-4-methyl-benzamide CAS Name: 3-benzamido-N-[(2-hydroxy-5-nitrophenyl)methyl]-4-methylbenzamide IUPAC Name: 3-benzamido-N-[(2-hydroxy-5-nitrophenyl)methyl]-4-methylbenzamide Traditional Name: 3-benzamido-N-(2-hydroxy-5-nitro-benzyl)-4-methyl-benzamide Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O5/c1-14-7-8-16(12-19(14)24-22(28)15-5-3-2-4-6-15)21(27)23-13-17-11-18(25(29)30)9-10-20(17)26/h2-12,26H,13H2,1H3,(H,23,27)(H,24,28)