methyl 5-[(E)-3-[(4-bromanyl-3-methyl-phenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[(E)-3-[(4-bromanyl-3-methyl-phenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[(E)-3-(4-bromo-3-methyl-anilino)-3-oxo-prop-1-enyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[(E)-3-(4-bromo-3-methylanilino)-3-oxoprop-1-enyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-3-(4-bromo-3-methylanilino)-3-oxoprop-1-enyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(E)-3-(4-bromo-3-methyl-anilino)-3-keto-prop-1-enyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C=CC2=CC(=C(O2)C)C(=O)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)/C=C/C2=CC(=C(O2)C)C(=O)OC)Br

InChI

InChI=1S/C17H16BrNO4/c1-10-8-12(4-6-15(10)18)19-16(20)7-5-13-9-14(11(2)23-13)17(21)22-3/h4-9H,1-3H3,(H,19,20)/b7-5+