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

Systemtic Name: 3-(3-methylbutylamino)-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-(isopentylamino)-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-(3-methylbutylamino)-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-(3-methylbutylamino)-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-(isoamylamino)-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C(=O)C1=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC1=C(C(=O)C1=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17NO2/c1-10(2)8-9-16-13-12(14(17)15(13)18)11-6-4-3-5-7-11/h3-7,10,16H,8-9H2,1-2H3