tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-ethyl-phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-ethyl-phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]-4-ethyl-phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-ethylanilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(5-chloropyridin-2-yl)carbamoyl]-4-ethylphenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]-4-ethyl-phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H31ClN4O4 MolecularWeight: 486.99104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CCC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C25H31ClN4O4/c1-5-16-6-8-20(19(14-16)23(32)29-21-9-7-18(26)15-27-21)28-22(31)17-10-12-30(13-11-17)24(33)34-25(2,3)4/h6-9,14-15,17H,5,10-13H2,1-4H3,(H,28,31)(H,27,29,32)