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

Systemtic Name: tert-butyl 4-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(5-chloropyridin-2-yl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H27ClN4O4 MolecularWeight: 458.93788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C23H27ClN4O4/c1-23(2,3)32-22(31)28-12-10-15(11-13-28)20(29)26-18-7-5-4-6-17(18)21(30)27-19-9-8-16(24)14-25-19/h4-9,14-15H,10-13H2,1-3H3,(H,26,29)(H,25,27,30)