[7-methyl-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isochromen-7-yl] propanoate

Systemtic Name: [7-methyl-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isochromen-7-yl] propanoate Openeye Name: [7-methyl-6,8-dioxo-3-(3-thienyl)isochromen-7-yl] propanoate CAS Name: propanoic acid [7-methyl-6,8-dioxo-3-(3-thiophenyl)-2-benzopyran-7-yl] ester IUPAC Name: (7-methyl-6,8-dioxo-3-thiophen-3-ylisochromen-7-yl) propanoate Traditional Name: propionic acid [6,8-diketo-7-methyl-3-(3-thienyl)isochromen-7-yl] ester Formula: C17H14O5S MolecularWeight: 330.35506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(C(=O)C=C2C=C(OC=C2C1=O)C3=CSC=C3)C

Isomeric SMILES

CCC(=O)OC1(C(=O)C=C2C=C(OC=C2C1=O)C3=CSC=C3)C

InChI

InChI=1S/C17H14O5S/c1-3-15(19)22-17(2)14(18)7-11-6-13(10-4-5-23-9-10)21-8-12(11)16(17)20/h4-9H,3H2,1-2H3