3-(7-butoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate

Systemtic Name: 3-(7-butoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate Openeye Name: 3-(7-butoxy-4-methyl-2-oxo-chromen-3-yl)propanoate CAS Name: 3-(7-butoxy-4-methyl-2-oxo-1-benzopyran-3-yl)propanoate IUPAC Name: 3-(7-butoxy-4-methyl-2-oxochromen-3-yl)propanoate Traditional Name: 3-(7-butoxy-2-keto-4-methyl-chromen-3-yl)propionate Formula: C17H19O5- MolecularWeight: 303.32976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)[O-])C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)[O-])C

InChI

InChI=1S/C17H20O5/c1-3-4-9-21-12-5-6-13-11(2)14(7-8-16(18)19)17(20)22-15(13)10-12/h5-6,10H,3-4,7-9H2,1-2H3,(H,18,19)/p-1