tert-butyl 3-[[1-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[1-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[1-[2-(4-methylanilino)-2-oxo-ethyl]-3-piperidyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[1-[2-(4-methylanilino)-2-oxoethyl]-3-piperidinyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[1-[2-(4-methylanilino)-2-oxoethyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[1-[2-keto-2-(p-toluidino)ethyl]-3-piperidyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H38N4O4 MolecularWeight: 458.59362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCCC(C2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCCC(C2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H38N4O4/c1-18-9-11-20(12-10-18)26-22(30)17-28-13-6-8-21(16-28)27-23(31)19-7-5-14-29(15-19)24(32)33-25(2,3)4/h9-12,19,21H,5-8,13-17H2,1-4H3,(H,26,30)(H,27,31)