N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-4-methoxy-3-pyrrolidinosulfonyl-benzamide Formula: C21H25BrN2O5S MolecularWeight: 497.4026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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