N-(3-acetamido-4-methoxy-phenyl)-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)OC

InChI

InChI=1S/C20H22ClN3O5S/c1-13(25)22-18-11-14(5-8-19(18)29-2)23-20(26)16-12-15(6-7-17(16)21)30(27,28)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,25)(H,23,26)