3-bromanyl-N-[2-[1-[4-(2-prop-2-enylphenoxy)butyl]benzimidazol-2-yl]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[1-[4-(2-prop-2-enylphenoxy)butyl]benzimidazol-2-yl]ethyl]benzamide Openeye Name: N-[2-[1-[4-(2-allylphenoxy)butyl]benzimidazol-2-yl]ethyl]-3-bromo-benzamide CAS Name: 3-bromo-N-[2-[1-[4-(2-prop-2-enylphenoxy)butyl]-2-benzimidazolyl]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-[1-[4-(2-prop-2-enylphenoxy)butyl]benzimidazol-2-yl]ethyl]benzamide Traditional Name: N-[2-[1-[4-(2-allylphenoxy)butyl]benzimidazol-2-yl]ethyl]-3-bromo-benzamide Formula: C29H30BrN3O2 MolecularWeight: 532.4714

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCCCCN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C=CCC1=CC=CC=C1OCCCCN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C29H30BrN3O2/c1-2-10-22-11-3-6-16-27(22)35-20-8-7-19-33-26-15-5-4-14-25(26)32-28(33)17-18-31-29(34)23-12-9-13-24(30)21-23/h2-6,9,11-16,21H,1,7-8,10,17-20H2,(H,31,34)