ethyl (E)-3-[(2S)-2-methyl-7-oxidanyl-4-oxidanylidene-8-propyl-3H-chromen-2-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[(2S)-2-methyl-7-oxidanyl-4-oxidanylidene-8-propyl-3H-chromen-2-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[(2S)-7-hydroxy-2-methyl-4-oxo-8-propyl-chroman-2-yl]prop-2-enoate CAS Name: (E)-3-[(2S)-7-hydroxy-2-methyl-4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(2S)-7-hydroxy-2-methyl-4-oxo-8-propyl-3H-chromen-2-yl]prop-2-enoate Traditional Name: (E)-3-[(2S)-7-hydroxy-4-keto-2-methyl-8-propyl-chroman-2-yl]acrylic acid ethyl ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2=O)(C)C=CC(=O)OCC)O

Isomeric SMILES

CCCC1=C(C=CC2=C1O[C@](CC2=O)(C)/C=C/C(=O)OCC)O

InChI

InChI=1S/C18H22O5/c1-4-6-12-14(19)8-7-13-15(20)11-18(3,23-17(12)13)10-9-16(21)22-5-2/h7-10,19H,4-6,11H2,1-3H3/b10-9+/t18-/m1/s1