methyl (2R)-2-[cyclohexen-1-yl-[(1R)-1-phenylethyl]amino]-3-iodanyl-propanoate

Systemtic Name: methyl (2R)-2-[cyclohexen-1-yl-[(1R)-1-phenylethyl]amino]-3-iodanyl-propanoate Openeye Name: methyl (2R)-2-[cyclohexen-1-yl-[(1R)-1-phenylethyl]amino]-3-iodo-propanoate CAS Name: (2R)-2-[1-cyclohexenyl-[(1R)-1-phenylethyl]amino]-3-iodopropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[cyclohexen-1-yl-[(1R)-1-phenylethyl]amino]-3-iodopropanoate Traditional Name: (2R)-2-[cyclohexen-1-yl-[(1R)-1-phenylethyl]amino]-3-iodo-propionic acid methyl ester Formula: C18H24INO2 MolecularWeight: 413.29313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C2=CCCCC2)C(CI)C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(C2=CCCCC2)[C@@H](CI)C(=O)OC

InChI

InChI=1S/C18H24INO2/c1-14(15-9-5-3-6-10-15)20(16-11-7-4-8-12-16)17(13-19)18(21)22-2/h3,5-6,9-11,14,17H,4,7-8,12-13H2,1-2H3/t14-,17+/m1/s1