N-(3-azanylpropyl)-2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-6-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-6-methyl-benzamide Openeye Name: N-(3-aminopropyl)-2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-6-methyl-benzamide CAS Name: N-(3-aminopropyl)-2-[2-(5-bromo-2-methoxyphenyl)ethyl]-6-methylbenzamide IUPAC Name: N-(3-aminopropyl)-2-[2-(5-bromo-2-methoxyphenyl)ethyl]-6-methylbenzamide Traditional Name: N-(3-aminopropyl)-2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-6-methyl-benzamide Formula: C20H25BrN2O2 MolecularWeight: 405.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CCC2=C(C=CC(=C2)Br)OC)C(=O)NCCCN

Isomeric SMILES

CC1=C(C(=CC=C1)CCC2=C(C=CC(=C2)Br)OC)C(=O)NCCCN

InChI

InChI=1S/C20H25BrN2O2/c1-14-5-3-6-15(19(14)20(24)23-12-4-11-22)7-8-16-13-17(21)9-10-18(16)25-2/h3,5-6,9-10,13H,4,7-8,11-12,22H2,1-2H3,(H,23,24)