N-(5-chloranyl-2-methyl-phenyl)-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzamide CAS Name: N-(5-chloro-2-methylphenyl)-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzamide IUPAC Name: N-(5-chloro-2-methylphenyl)-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzamide Formula: C22H20ClN3O3 MolecularWeight: 409.8655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClN3O3/c1-14-8-10-18(23)13-20(14)25-22(27)17-9-11-19(21(12-17)26(28)29)24-15(2)16-6-4-3-5-7-16/h3-13,15,24H,1-2H3,(H,25,27)/t15-/m1/s1