tert-butyl N-[1-[[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]amino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H26BrClN2O6 MolecularWeight: 565.84074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C(=C(OC3=O)OCCBr)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C(=C(OC3=O)OCCBr)Cl

InChI

InChI=1S/C25H26BrClN2O6/c1-25(2,3)35-24(32)29-19(13-15-7-5-4-6-8-15)21(30)28-16-9-10-17-18(14-16)22(31)34-23(20(17)27)33-12-11-26/h4-10,14,19H,11-13H2,1-3H3,(H,28,30)(H,29,32)