3-(4-dimethylaminophenyl)-4-(2-oxidanylpropylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(4-dimethylaminophenyl)-4-(2-oxidanylpropylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-dimethylaminophenyl)-4-(2-hydroxypropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-dimethylaminophenyl)-4-(2-hydroxypropylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-dimethylaminophenyl)-4-(2-hydroxypropylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-dimethylaminophenyl)-4-(2-hydroxypropylamino)cyclobut-3-ene-1,2-quinone Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C(=O)C1=O)C2=CC=C(C=C2)N(C)C)O

Isomeric SMILES

CC(CNC1=C(C(=O)C1=O)C2=CC=C(C=C2)N(C)C)O

InChI

InChI=1S/C15H18N2O3/c1-9(18)8-16-13-12(14(19)15(13)20)10-4-6-11(7-5-10)17(2)3/h4-7,9,16,18H,8H2,1-3H3