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

Systemtic Name: 1-[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]urea CAS Name: 1-[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]urea Traditional Name: 1-benzyl-3-[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]urea Formula: C19H16BrClN2O4 MolecularWeight: 451.69834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)C(=C(OC3=O)OCCBr)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)C(=C(OC3=O)OCCBr)Cl

InChI

InChI=1S/C19H16BrClN2O4/c20-8-9-26-18-16(21)14-7-6-13(10-15(14)17(24)27-18)23-19(25)22-11-12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H2,22,23,25)