4-[13-(4-chlorophenyl)tridec-12-ynylamino]-N-(phenylcarbonyl)benzamide

Systemtic Name: 4-[13-(4-chlorophenyl)tridec-12-ynylamino]-N-(phenylcarbonyl)benzamide Openeye Name: N-benzoyl-4-[13-(4-chlorophenyl)tridec-12-ynylamino]benzamide CAS Name: N-benzoyl-4-[13-(4-chlorophenyl)tridec-12-ynylamino]benzamide IUPAC Name: N-benzoyl-4-[13-(4-chlorophenyl)tridec-12-ynylamino]benzamide Traditional Name: N-benzoyl-4-[13-(4-chlorophenyl)tridec-12-ynylamino]benzamide Formula: C33H37ClN2O2 MolecularWeight: 529.11208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=O)C2=CC=C(C=C2)NCCCCCCCCCCCC#CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=O)C2=CC=C(C=C2)NCCCCCCCCCCCC#CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C33H37ClN2O2/c34-30-22-18-27(19-23-30)15-11-8-6-4-2-1-3-5-7-9-14-26-35-31-24-20-29(21-25-31)33(38)36-32(37)28-16-12-10-13-17-28/h10,12-13,16-25,35H,1-9,14,26H2,(H,36,37,38)