COc1cc(CC(=O)Nc2cccc(I)c2)ccc1OCCNC(=O)OC(C)(C)C
名称: Intermediate 4
IUPAC: tert-butyl N-[2-[4-[2-(3-iodoanilino)-2-oxoethyl]-2-methoxyphenoxy]ethyl]carbamate
SMILES: COc1cc(CC(=O)Nc2cccc(I)c2)ccc1OCCNC(=O)OC(C)(C)C
Canonical SMILES: CC(C)(C)OC(=O)NCCOC1=C(C=C(C=C1)CC(=O)NC2=CC(=CC=C2)I)OC
分子式: C22H27IN2O5
分子量: 526.40
InChIKey: MHKHICUDLCDHEB-UHFFFAOYSA-N
InChI: InChI=1S/C22H27IN2O5/c1-22(2,3)30-21(27)24-10-11-29-18-9-8-15(12-19(18)28-4)13-20(26)25-17-7-5-6-16(23)14-17/h5-9,12,14H,10-11,13H2,1-4H3,(H,24,27)(H,25,26)
PubChem CID: 22019609

同義語

SCHEMBL6101715MHKHICUDLCDHEB-UHFFFAOYSA-N4-[2-(tert-butoxycarbonylamino)ethoxy]-N-(3-iodophenyl)-3-methoxyphenylacetamide