N'-tert-butyl-5-chloranyl-N'-(3-iodanylphenyl)carbonyl-3,4-dihydro-2H-chromene-6-carbohydrazide

Systemtic Name: N'-tert-butyl-5-chloranyl-N'-(3-iodanylphenyl)carbonyl-3,4-dihydro-2H-chromene-6-carbohydrazide Openeye Name: N'-tert-butyl-5-chloro-N'-(3-iodobenzoyl)chromane-6-carbohydrazide CAS Name: N'-tert-butyl-5-chloro-N'-[(3-iodophenyl)-oxomethyl]-3,4-dihydro-2H-1-benzopyran-6-carbohydrazide IUPAC Name: N'-tert-butyl-5-chloro-N'-(3-iodobenzoyl)-3,4-dihydro-2H-chromene-6-carbohydrazide Traditional Name: N'-tert-butyl-5-chloro-N'-(3-iodobenzoyl)chroman-6-carbohydrazide Formula: C21H22ClIN2O3 MolecularWeight: 512.76845

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C(=O)C1=CC(=CC=C1)I)NC(=O)C2=C(C3=C(C=C2)OCCC3)Cl

Isomeric SMILES

CC(C)(C)N(C(=O)C1=CC(=CC=C1)I)NC(=O)C2=C(C3=C(C=C2)OCCC3)Cl

InChI

InChI=1S/C21H22ClIN2O3/c1-21(2,3)25(20(27)13-6-4-7-14(23)12-13)24-19(26)16-9-10-17-15(18(16)22)8-5-11-28-17/h4,6-7,9-10,12H,5,8,11H2,1-3H3,(H,24,26)