tert-butyl 4-[ethyl-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[ethyl-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[ethyl-[2-(4-methoxyanilino)-2-oxo-ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[ethyl-[2-(4-methoxyanilino)-2-oxoethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[ethyl-[2-(4-methoxyanilino)-2-oxoethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[ethyl-[2-keto-2-(p-anisidino)ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O5 MolecularWeight: 419.51452

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC=C(C=C1)OC)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCN(CC(=O)NC1=CC=C(C=C1)OC)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33N3O5/c1-6-24(15-19(26)23-17-7-9-18(29-5)10-8-17)20(27)16-11-13-25(14-12-16)21(28)30-22(2,3)4/h7-10,16H,6,11-15H2,1-5H3,(H,23,26)