tert-butyl N-[1-[(5-chloranyl-1,2-benzoxazol-3-yl)oxy]-3-cyano-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(5-chloranyl-1,2-benzoxazol-3-yl)oxy]-3-cyano-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(5-chloro-1,2-benzoxazol-3-yl)oxymethyl]-2-cyano-ethyl]carbamate CAS Name: N-[1-[(5-chloro-1,2-benzoxazol-3-yl)oxy]-3-cyanopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(5-chloro-1,2-benzoxazol-3-yl)oxy]-3-cyanopropan-2-yl]carbamate Traditional Name: N-[1-[(5-chloroindoxazen-3-yl)oxymethyl]-2-cyano-ethyl]carbamic acid tert-butyl ester Formula: C16H18ClN3O4 MolecularWeight: 351.78482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#N)COC1=NOC2=C1C=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC#N)COC1=NOC2=C1C=C(C=C2)Cl

InChI

InChI=1S/C16H18ClN3O4/c1-16(2,3)23-15(21)19-11(6-7-18)9-22-14-12-8-10(17)4-5-13(12)24-20-14/h4-5,8,11H,6,9H2,1-3H3,(H,19,21)