[1-[[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]amino]-1-oxidanylidene-propan-2-yl] N-phenylcarbamate

Systemtic Name: [1-[[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]amino]-1-oxidanylidene-propan-2-yl] N-phenylcarbamate Openeye Name: [2-[[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]amino]-1-methyl-2-oxo-ethyl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [1-[[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]amino]-1-oxopropan-2-yl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [2-[[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]amino]-2-keto-1-methyl-ethyl] ester Formula: C21H18BrClN2O6 MolecularWeight: 509.73442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)C(=C(OC2=O)OCCBr)Cl)OC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=C(OC2=O)OCCBr)Cl)OC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H18BrClN2O6/c1-12(30-21(28)25-13-5-3-2-4-6-13)18(26)24-14-7-8-15-16(11-14)19(27)31-20(17(15)23)29-10-9-22/h2-8,11-12H,9-10H2,1H3,(H,24,26)(H,25,28)