methyl N-[2-(cyclohexen-1-yl)-2-[(6-iodanyl-1,3-benzodioxol-5-yl)methoxy]ethyl]carbamate

Systemtic Name: methyl N-[2-(cyclohexen-1-yl)-2-[(6-iodanyl-1,3-benzodioxol-5-yl)methoxy]ethyl]carbamate Openeye Name: methyl N-[2-(cyclohexen-1-yl)-2-[(6-iodo-1,3-benzodioxol-5-yl)methoxy]ethyl]carbamate CAS Name: N-[2-(1-cyclohexenyl)-2-[(6-iodo-1,3-benzodioxol-5-yl)methoxy]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(cyclohexen-1-yl)-2-[(6-iodo-1,3-benzodioxol-5-yl)methoxy]ethyl]carbamate Traditional Name: N-[2-(cyclohexen-1-yl)-2-[(6-iodo-1,3-benzodioxol-5-yl)methoxy]ethyl]carbamic acid methyl ester Formula: C18H22INO5 MolecularWeight: 459.27545

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NCC(C1=CCCCC1)OCC2=CC3=C(C=C2I)OCO3

Isomeric SMILES

COC(=O)NCC(C1=CCCCC1)OCC2=CC3=C(C=C2I)OCO3

InChI

InChI=1S/C18H22INO5/c1-22-18(21)20-9-17(12-5-3-2-4-6-12)23-10-13-7-15-16(8-14(13)19)25-11-24-15/h5,7-8,17H,2-4,6,9-11H2,1H3,(H,20,21)