ethyl 3-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C19H26BrN3O4 MolecularWeight: 440.33144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)N(C)CC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)N(C)CC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C19H26BrN3O4/c1-4-27-19(26)23-9-5-6-14(11-23)18(25)22(3)12-17(24)21-16-8-7-15(20)10-13(16)2/h7-8,10,14H,4-6,9,11-12H2,1-3H3,(H,21,24)