N-(5-chloranyl-2-methyl-phenyl)-3-nitro-4-[(phenylmethyl)amino]benzamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-3-nitro-4-[(phenylmethyl)amino]benzamide Openeye Name: 4-(benzylamino)-N-(5-chloro-2-methyl-phenyl)-3-nitro-benzamide CAS Name: N-(5-chloro-2-methylphenyl)-3-nitro-4-[(phenylmethyl)amino]benzamide IUPAC Name: 4-(benzylamino)-N-(5-chloro-2-methylphenyl)-3-nitrobenzamide Traditional Name: 4-(benzylamino)-N-(5-chloro-2-methyl-phenyl)-3-nitro-benzamide Formula: C21H18ClN3O3 MolecularWeight: 395.83892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN3O3/c1-14-7-9-17(22)12-19(14)24-21(26)16-8-10-18(20(11-16)25(27)28)23-13-15-5-3-2-4-6-15/h2-12,23H,13H2,1H3,(H,24,26)