2-[[2-(3,4-dimethoxyphenyl)ethylamino]-(4-methoxyphenyl)methylidene]indene-1,3-dione

Systemtic Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-(4-methoxyphenyl)methylidene]indene-1,3-dione Openeye Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-(4-methoxyphenyl)methylene]indane-1,3-dione CAS Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-(4-methoxyphenyl)methylidene]indene-1,3-dione IUPAC Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-(4-methoxyphenyl)methylidene]indene-1,3-dione Traditional Name: 2-[(homoveratrylamino)-(4-methoxyphenyl)methylene]indane-1,3-quinone Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C2C(=O)C3=CC=CC=C3C2=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=C2C(=O)C3=CC=CC=C3C2=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H25NO5/c1-31-19-11-9-18(10-12-19)25(24-26(29)20-6-4-5-7-21(20)27(24)30)28-15-14-17-8-13-22(32-2)23(16-17)33-3/h4-13,16,28H,14-15H2,1-3H3