2-bromanyl-N-[(3-methoxyphenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[(3-methoxyphenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[(3-methoxyphenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[(3-methoxyphenyl)methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[(3-methoxyphenyl)methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-m-anisyl-5-pyrrolidinosulfonyl-benzamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-26-15-6-4-5-14(11-15)13-21-19(23)17-12-16(7-8-18(17)20)27(24,25)22-9-2-3-10-22/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,21,23)