3-(3,4-dimethylphenyl)-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,4-dimethylphenyl)-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione Openeye Name: 3-(3,4-dimethylphenyl)-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione CAS Name: 3-(3,4-dimethylphenyl)-4-(1-pyrrolidinyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,4-dimethylphenyl)-4-pyrrolidin-1-ylcyclobut-3-ene-1,2-dione Traditional Name: 3-(3,4-dimethylphenyl)-4-pyrrolidino-cyclobut-3-ene-1,2-quinone Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=O)C2=O)N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=O)C2=O)N3CCCC3)C

InChI

InChI=1S/C16H17NO2/c1-10-5-6-12(9-11(10)2)13-14(16(19)15(13)18)17-7-3-4-8-17/h5-6,9H,3-4,7-8H2,1-2H3