tert-butyl N-[1-[(4-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(4-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(benzyloxymethyl)-2-(4-chloro-2-methyl-anilino)-2-oxo-ethyl]carbamate CAS Name: N-[1-(4-chloro-2-methylanilino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-chloro-2-methylanilino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamate Traditional Name: N-[1-(benzoxymethyl)-2-(4-chloro-2-methyl-anilino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)C(COCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)C(COCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H27ClN2O4/c1-15-12-17(23)10-11-18(15)24-20(26)19(25-21(27)29-22(2,3)4)14-28-13-16-8-6-5-7-9-16/h5-12,19H,13-14H2,1-4H3,(H,24,26)(H,25,27)