2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(2-chloranyl-4-fluoranyl-phenyl)propanamide; ethanedioic acid

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(2-chloranyl-4-fluoranyl-phenyl)propanamide; ethanedioic acid Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]-N-(2-chloro-4-fluoro-phenyl)propanamide; oxalic acid CAS Name: 2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-N-(2-chloro-4-fluorophenyl)propanamide; oxalic acid IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-N-(2-chloro-4-fluorophenyl)propanamide; oxalic acid Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)-methyl-amino]-N-(2-chloro-4-fluoro-phenyl)propionamide; oxalic acid Formula: C20H21BrClFN2O6 MolecularWeight: 519.745943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)N(C)CC2=C(C=CC(=C2)Br)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)N(C)CC2=C(C=CC(=C2)Br)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H19BrClFN2O2.C2H2O4/c1-11(18(24)22-16-6-5-14(21)9-15(16)20)23(2)10-12-8-13(19)4-7-17(12)25-3;3-1(4)2(5)6/h4-9,11H,10H2,1-3H3,(H,22,24);(H,3,4)(H,5,6)