2-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylidene]indene-1,3-dione

Systemtic Name: 2-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylidene]indene-1,3-dione Openeye Name: 2-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylene]indane-1,3-dione CAS Name: 2-[(3-ethoxy-4-prop-2-ynoxyphenyl)methylidene]indene-1,3-dione IUPAC Name: 2-[(3-ethoxy-4-prop-2-ynoxyphenyl)methylidene]indene-1,3-dione Traditional Name: 2-(3-ethoxy-4-propargyloxy-benzylidene)indane-1,3-quinone Formula: C21H16O4 MolecularWeight: 332.34934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)OCC#C

InChI

InChI=1S/C21H16O4/c1-3-11-25-18-10-9-14(13-19(18)24-4-2)12-17-20(22)15-7-5-6-8-16(15)21(17)23/h1,5-10,12-13H,4,11H2,2H3