methyl 1-[2-(2-iodanyl-4-methoxy-phenyl)prop-2-enyl]-2-methyl-4-oxidanylidene-naphthalene-1-carboxylate

Systemtic Name: methyl 1-[2-(2-iodanyl-4-methoxy-phenyl)prop-2-enyl]-2-methyl-4-oxidanylidene-naphthalene-1-carboxylate Openeye Name: methyl 1-[2-(2-iodo-4-methoxy-phenyl)allyl]-2-methyl-4-oxo-naphthalene-1-carboxylate CAS Name: 1-[2-(2-iodo-4-methoxyphenyl)prop-2-enyl]-2-methyl-4-oxo-1-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-iodo-4-methoxyphenyl)prop-2-enyl]-2-methyl-4-oxonaphthalene-1-carboxylate Traditional Name: 1-[2-(2-iodo-4-methoxy-phenyl)allyl]-4-keto-2-methyl-naphthalene-1-carboxylic acid methyl ester Formula: C23H21IO4 MolecularWeight: 488.31491

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=CC=CC=C2C1(CC(=C)C3=C(C=C(C=C3)OC)I)C(=O)OC

Isomeric SMILES

CC1=CC(=O)C2=CC=CC=C2C1(CC(=C)C3=C(C=C(C=C3)OC)I)C(=O)OC

InChI

InChI=1S/C23H21IO4/c1-14(17-10-9-16(27-3)12-20(17)24)13-23(22(26)28-4)15(2)11-21(25)18-7-5-6-8-19(18)23/h5-12H,1,13H2,2-4H3