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

Systemtic Name: 3-[2-(3,4-diethoxyphenyl)ethylamino]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[2-(3,4-diethoxyphenyl)ethylamino]-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[2-(3,4-diethoxyphenyl)ethylamino]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[2-(3,4-diethoxyphenyl)ethylamino]-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-[2-(3,4-diethoxyphenyl)ethylamino]-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC2=C(C(=O)C2=O)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC2=C(C(=O)C2=O)C3=CC=CC=C3)OCC

InChI

InChI=1S/C22H23NO4/c1-3-26-17-11-10-15(14-18(17)27-4-2)12-13-23-20-19(21(24)22(20)25)16-8-6-5-7-9-16/h5-11,14,23H,3-4,12-13H2,1-2H3