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

Systemtic Name: 1-[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-3-tert-butyl-urea Openeye Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]-3-tert-butyl-urea CAS Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]-3-tert-butylurea IUPAC Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]-3-tert-butylurea Traditional Name: 1-[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]-3-tert-butyl-urea Formula: C16H18BrClN2O4 MolecularWeight: 417.68212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CC2=C(C=C1)C(=C(OC2=O)OCCBr)Cl

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CC2=C(C=C1)C(=C(OC2=O)OCCBr)Cl

InChI

InChI=1S/C16H18BrClN2O4/c1-16(2,3)20-15(22)19-9-4-5-10-11(8-9)13(21)24-14(12(10)18)23-7-6-17/h4-5,8H,6-7H2,1-3H3,(H2,19,20,22)