3-bromanyl-5-methoxy-4-propoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 3-bromanyl-5-methoxy-4-propoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 3-bromo-5-methoxy-4-propoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 3-bromo-5-methoxy-4-propoxy-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-bromo-5-methoxy-4-propoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-bromo-5-methoxy-4-propoxy-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C21H25BrN2O5S MolecularWeight: 497.4026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C21H25BrN2O5S/c1-3-12-29-20-18(22)13-15(14-19(20)28-2)21(25)23-16-6-8-17(9-7-16)30(26,27)24-10-4-5-11-24/h6-9,13-14H,3-5,10-12H2,1-2H3,(H,23,25)