methyl 2-methyl-5-[(E)-3-(3-methylbutylamino)-3-oxidanylidene-prop-1-enyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(E)-3-(3-methylbutylamino)-3-oxidanylidene-prop-1-enyl]furan-3-carboxylate Openeye Name: methyl 5-[(E)-3-(isopentylamino)-3-oxo-prop-1-enyl]-2-methyl-furan-3-carboxylate CAS Name: 2-methyl-5-[(E)-3-(3-methylbutylamino)-3-oxoprop-1-enyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(E)-3-(3-methylbutylamino)-3-oxoprop-1-enyl]furan-3-carboxylate Traditional Name: 5-[(E)-3-(isoamylamino)-3-keto-prop-1-enyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C=CC(=O)NCCC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)/C=C/C(=O)NCCC(C)C)C(=O)OC

InChI

InChI=1S/C15H21NO4/c1-10(2)7-8-16-14(17)6-5-12-9-13(11(3)20-12)15(18)19-4/h5-6,9-10H,7-8H2,1-4H3,(H,16,17)/b6-5+