ethyl (E)-4-[[(E)-2-iodanyl-3-(phenylsulfonyl)prop-2-enyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[[(E)-2-iodanyl-3-(phenylsulfonyl)prop-2-enyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[[(E)-3-(benzenesulfonyl)-2-iodo-allyl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[(E)-3-(benzenesulfonyl)-2-iodoprop-2-enyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[[(E)-3-(benzenesulfonyl)-2-iodoprop-2-enyl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[[(E)-3-besyl-2-iodo-allyl]amino]-4-keto-but-2-enoic acid ethyl ester Formula: C15H16INO5S MolecularWeight: 449.26071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)NCC(=CS(=O)(=O)C1=CC=CC=C1)I

Isomeric SMILES

CCOC(=O)/C=C/C(=O)NC/C(=C\S(=O)(=O)C1=CC=CC=C1)/I

InChI

InChI=1S/C15H16INO5S/c1-2-22-15(19)9-8-14(18)17-10-12(16)11-23(20,21)13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,17,18)/b9-8+,12-11+