1-[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-1-(1-phenylethyl)urea

Systemtic Name: 1-[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-1-(1-phenylethyl)urea Openeye Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]-1-(1-phenylethyl)urea CAS Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]-1-(1-phenylethyl)urea IUPAC Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]-1-(1-phenylethyl)urea Traditional Name: 1-[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]-1-(1-phenylethyl)urea Formula: C20H18BrClN2O4 MolecularWeight: 465.72492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C2=CC3=C(C=C2)C(=C(OC3=O)OCCBr)Cl)C(=O)N

Isomeric SMILES

CC(C1=CC=CC=C1)N(C2=CC3=C(C=C2)C(=C(OC3=O)OCCBr)Cl)C(=O)N

InChI

InChI=1S/C20H18BrClN2O4/c1-12(13-5-3-2-4-6-13)24(20(23)26)14-7-8-15-16(11-14)18(25)28-19(17(15)22)27-10-9-21/h2-8,11-12H,9-10H2,1H3,(H2,23,26)