4-[[[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[[3-(4-bromophenoxy)-2-hydroxy-propyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[[3-(4-bromophenoxy)-2-hydroxypropyl]-methylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[[3-(4-bromophenoxy)-2-hydroxypropyl]-methylamino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[[3-(4-bromophenoxy)-2-hydroxy-propyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)CC(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)CC(COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C21H25BrN2O3/c1-24(13-19(25)14-27-20-10-6-17(22)7-11-20)12-15-2-4-16(5-3-15)21(26)23-18-8-9-18/h2-7,10-11,18-19,25H,8-9,12-14H2,1H3,(H,23,26)