tert-butyl 3-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]carbamoyloxy]azetidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]carbamoyloxy]azetidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]carbamoyloxy]azetidine-1-carboxylate CAS Name: 3-[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]anilino]-oxomethoxy]-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-[(5-chloropyridin-2-yl)carbamoyl]phenyl]carbamoyloxy]azetidine-1-carboxylate Traditional Name: 3-[[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]carbamoyloxy]azetidine-1-carboxylic acid tert-butyl ester Formula: C21H23ClN4O5 MolecularWeight: 446.88412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C1)OC(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C1)OC(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN4O5/c1-21(2,3)31-20(29)26-11-14(12-26)30-19(28)24-16-7-5-4-6-15(16)18(27)25-17-9-8-13(22)10-23-17/h4-10,14H,11-12H2,1-3H3,(H,24,28)(H,23,25,27)