tert-butyl 4-[[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(2,5-dimethylanilino)-2-oxo-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[2-(2,5-dimethylanilino)-2-oxoethyl]-methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(2,5-dimethylanilino)-2-oxoethyl]-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-(2,5-dimethylanilino)-2-keto-ethyl]-methyl-carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33N3O4/c1-15-7-8-16(2)18(13-15)23-19(26)14-24(6)20(27)17-9-11-25(12-10-17)21(28)29-22(3,4)5/h7-8,13,17H,9-12,14H2,1-6H3,(H,23,26)