N-(4-butylphenyl)-4-chloranyl-3-methylsulfonyl-benzamide

Systemtic Name: N-(4-butylphenyl)-4-chloranyl-3-methylsulfonyl-benzamide Openeye Name: N-(4-butylphenyl)-4-chloro-3-methylsulfonyl-benzamide CAS Name: N-(4-butylphenyl)-4-chloro-3-methylsulfonylbenzamide IUPAC Name: N-(4-butylphenyl)-4-chloro-3-methylsulfonylbenzamide Traditional Name: N-(4-butylphenyl)-4-chloro-3-mesyl-benzamide Formula: C18H20ClNO3S MolecularWeight: 365.8743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H20ClNO3S/c1-3-4-5-13-6-9-15(10-7-13)20-18(21)14-8-11-16(19)17(12-14)24(2,22)23/h6-12H,3-5H2,1-2H3,(H,20,21)