3-(butan-2-ylamino)-4-phenyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(butan-2-ylamino)-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-phenyl-4-(sec-butylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(butan-2-ylamino)-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-(butan-2-ylamino)-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-phenyl-4-(sec-butylamino)cyclobut-3-ene-1,2-quinone Formula: C14H15NO2 MolecularWeight: 229.2744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=O)C1=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C)NC1=C(C(=O)C1=O)C2=CC=CC=C2

InChI

InChI=1S/C14H15NO2/c1-3-9(2)15-12-11(13(16)14(12)17)10-7-5-4-6-8-10/h4-9,15H,3H2,1-2H3