3-(7-butoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)propanoate

Systemtic Name: 3-(7-butoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)propanoate Openeye Name: 3-(7-butoxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoate CAS Name: 3-(7-butoxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)propanoate IUPAC Name: 3-(7-butoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoate Traditional Name: 3-(7-butoxy-2-keto-4,8-dimethyl-chromen-3-yl)propionate Formula: C18H21O5- MolecularWeight: 317.35634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=C(C=C1)C(=C(C(=O)O2)CCC(=O)[O-])C)C

Isomeric SMILES

CCCCOC1=C(C2=C(C=C1)C(=C(C(=O)O2)CCC(=O)[O-])C)C

InChI

InChI=1S/C18H22O5/c1-4-5-10-22-15-8-6-13-11(2)14(7-9-16(19)20)18(21)23-17(13)12(15)3/h6,8H,4-5,7,9-10H2,1-3H3,(H,19,20)/p-1