3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-phenyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-(homoveratrylamino)-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C(=O)C2=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C(=O)C2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H19NO4/c1-24-15-9-8-13(12-16(15)25-2)10-11-21-18-17(19(22)20(18)23)14-6-4-3-5-7-14/h3-9,12,21H,10-11H2,1-2H3