2-[4-(dibutylamino)but-1-ynyl]-2-phenyl-indene-1,3-dione

Systemtic Name: 2-[4-(dibutylamino)but-1-ynyl]-2-phenyl-indene-1,3-dione Openeye Name: 2-[4-(dibutylamino)but-1-ynyl]-2-phenyl-indane-1,3-dione CAS Name: 2-[4-(dibutylamino)but-1-ynyl]-2-phenylindene-1,3-dione IUPAC Name: 2-[4-(dibutylamino)but-1-ynyl]-2-phenylindene-1,3-dione Traditional Name: 2-[4-(dibutylamino)but-1-ynyl]-2-phenyl-indane-1,3-quinone Formula: C27H31NO2 MolecularWeight: 401.54054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCC#CC1(C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN(CCCC)CCC#CC1(C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C27H31NO2/c1-3-5-19-28(20-6-4-2)21-13-12-18-27(22-14-8-7-9-15-22)25(29)23-16-10-11-17-24(23)26(27)30/h7-11,14-17H,3-6,13,19-21H2,1-2H3