N-[4-[butyl(hexyl)amino]phenyl]-2-chloranyl-5-nitro-N-phenyl-benzamide

Systemtic Name: N-[4-[butyl(hexyl)amino]phenyl]-2-chloranyl-5-nitro-N-phenyl-benzamide Openeye Name: N-[4-[butyl(hexyl)amino]phenyl]-2-chloro-5-nitro-N-phenyl-benzamide CAS Name: N-[4-[butyl(hexyl)amino]phenyl]-2-chloro-5-nitro-N-phenylbenzamide IUPAC Name: N-[4-[butyl(hexyl)amino]phenyl]-2-chloro-5-nitro-N-phenylbenzamide Traditional Name: N-[4-[butyl(hexyl)amino]phenyl]-2-chloro-5-nitro-N-phenyl-benzamide Formula: C29H34ClN3O3 MolecularWeight: 508.05156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C29H34ClN3O3/c1-3-5-7-11-21-31(20-6-4-2)23-14-16-25(17-15-23)32(24-12-9-8-10-13-24)29(34)27-22-26(33(35)36)18-19-28(27)30/h8-10,12-19,22H,3-7,11,20-21H2,1-2H3