N-[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-3,3-dimethyl-butanamide

Systemtic Name: N-[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-3,3-dimethyl-butanamide Openeye Name: N-[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]-3,3-dimethyl-butanamide CAS Name: N-[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]-3,3-dimethylbutanamide IUPAC Name: N-[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]-3,3-dimethylbutanamide Traditional Name: N-[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]-3,3-dimethyl-butyramide Formula: C17H19BrClNO4 MolecularWeight: 416.69406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19BrClNO4/c1-17(2,3)9-13(21)20-10-4-5-11-12(8-10)15(22)24-16(14(11)19)23-7-6-18/h4-5,8H,6-7,9H2,1-3H3,(H,20,21)