tert-butyl N-[[1-(2-chloranylethanoyl)pyrrolidin-2-yl]carbonyl-phenyl-amino]carbamate

Systemtic Name: tert-butyl N-[[1-(2-chloranylethanoyl)pyrrolidin-2-yl]carbonyl-phenyl-amino]carbamate Openeye Name: tert-butyl N-(N-[1-(2-chloroacetyl)pyrrolidine-2-carbonyl]anilino)carbamate CAS Name: N-(N-[[1-(2-chloro-1-oxoethyl)-2-pyrrolidinyl]-oxomethyl]anilino)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(N-[1-(2-chloroacetyl)pyrrolidine-2-carbonyl]anilino)carbamate Traditional Name: N-(N-[1-(2-chloroacetyl)prolyl]anilino)carbamic acid tert-butyl ester Formula: C18H24ClN3O4 MolecularWeight: 381.85386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(C1=CC=CC=C1)C(=O)C2CCCN2C(=O)CCl

Isomeric SMILES

CC(C)(C)OC(=O)NN(C1=CC=CC=C1)C(=O)C2CCCN2C(=O)CCl

InChI

InChI=1S/C18H24ClN3O4/c1-18(2,3)26-17(25)20-22(13-8-5-4-6-9-13)16(24)14-10-7-11-21(14)15(23)12-19/h4-6,8-9,14H,7,10-12H2,1-3H3,(H,20,25)