methyl 4-iodanyl-5-methyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-iodanyl-5-methyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4-iodo-5-methyl-1H-pyrrole-2-carboxylate CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4-iodo-5-methyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4-iodo-5-methyl-1H-pyrrole-2-carboxylate Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4-iodo-5-methyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C16H15IN2O3 MolecularWeight: 410.20637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C(=O)OC)C=CC(=O)NC2=CC=CC=C2)I

Isomeric SMILES

CC1=C(C(=C(N1)C(=O)OC)/C=C/C(=O)NC2=CC=CC=C2)I

InChI

InChI=1S/C16H15IN2O3/c1-10-14(17)12(15(18-10)16(21)22-2)8-9-13(20)19-11-6-4-3-5-7-11/h3-9,18H,1-2H3,(H,19,20)/b9-8+