N-[2-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[2-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylamino]-2-oxo-ethyl]-3,5-dimethyl-benzamide CAS Name: N-[2-[2-(2-bromo-4,5-dimethoxyphenyl)ethylamino]-2-oxoethyl]-3,5-dimethylbenzamide IUPAC Name: N-[2-[2-(2-bromo-4,5-dimethoxyphenyl)ethylamino]-2-oxoethyl]-3,5-dimethylbenzamide Traditional Name: N-[2-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylamino]-2-keto-ethyl]-3,5-dimethyl-benzamide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCCC2=CC(=C(C=C2Br)OC)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCCC2=CC(=C(C=C2Br)OC)OC)C

InChI

InChI=1S/C21H25BrN2O4/c1-13-7-14(2)9-16(8-13)21(26)24-12-20(25)23-6-5-15-10-18(27-3)19(28-4)11-17(15)22/h7-11H,5-6,12H2,1-4H3,(H,23,25)(H,24,26)