(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[3-(2-oxoazepan-1-yl)propyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[3-(2-oxoazepan-1-yl)propyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[3-(2-ketoazepan-1-yl)propyl]acrylamide Formula: C19H25BrN2O3 MolecularWeight: 409.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NCCCN2CCCCCC2=O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NCCCN2CCCCCC2=O

InChI

InChI=1S/C19H25BrN2O3/c1-25-17-9-8-16(20)14-15(17)7-10-18(23)21-11-5-13-22-12-4-2-3-6-19(22)24/h7-10,14H,2-6,11-13H2,1H3,(H,21,23)/b10-7+