tert-butyl 3-[[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-(2-methoxy-5-methyl-anilino)-2-oxo-ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[2-(2-methoxy-5-methylanilino)-2-oxoethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-(2-methoxy-5-methylanilino)-2-oxoethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[2-keto-2-(2-methoxy-5-methyl-anilino)ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)C2CCCN(C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)C2CCCN(C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31N3O5/c1-14-8-9-17(28-5)16(11-14)23-18(25)12-22-19(26)15-7-6-10-24(13-15)20(27)29-21(2,3)4/h8-9,11,15H,6-7,10,12-13H2,1-5H3,(H,22,26)(H,23,25)