methyl (2S)-2-[[(E)-5-(furan-2-yl)-3-oxidanylidene-pent-4-enyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[(E)-5-(furan-2-yl)-3-oxidanylidene-pent-4-enyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[(E)-5-(2-furyl)-3-oxo-pent-4-enyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(E)-5-(2-furanyl)-3-oxopent-4-enyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(E)-5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(E)-5-(2-furyl)-3-keto-pent-4-enyl]amino]-4-methyl-valeric acid methyl ester Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NCCC(=O)C=CC1=CC=CO1

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NCCC(=O)/C=C/C1=CC=CO1

InChI

InChI=1S/C16H23NO4/c1-12(2)11-15(16(19)20-3)17-9-8-13(18)6-7-14-5-4-10-21-14/h4-7,10,12,15,17H,8-9,11H2,1-3H3/b7-6+/t15-/m0/s1