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

Systemtic Name: ethyl 3-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[2-(4-bromo-2-methylanilino)-2-oxoethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C18H24BrN3O4 MolecularWeight: 426.30486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C18H24BrN3O4/c1-3-26-18(25)22-8-4-5-13(11-22)17(24)20-10-16(23)21-15-7-6-14(19)9-12(15)2/h6-7,9,13H,3-5,8,10-11H2,1-2H3,(H,20,24)(H,21,23)