2-[4-(dimethylamino)but-2-ynyl]-2-(phenylmethyl)indene-1,3-dione

Systemtic Name: 2-[4-(dimethylamino)but-2-ynyl]-2-(phenylmethyl)indene-1,3-dione Openeye Name: 2-benzyl-2-[4-(dimethylamino)but-2-ynyl]indane-1,3-dione CAS Name: 2-[4-(dimethylamino)but-2-ynyl]-2-(phenylmethyl)indene-1,3-dione IUPAC Name: 2-benzyl-2-[4-(dimethylamino)but-2-ynyl]indene-1,3-dione Traditional Name: 2-benzyl-2-[4-(dimethylamino)but-2-ynyl]indane-1,3-quinone Formula: C22H21NO2 MolecularWeight: 331.40764

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CCC1(C(=O)C2=CC=CC=C2C1=O)CC3=CC=CC=C3

Isomeric SMILES

CN(C)CC#CCC1(C(=O)C2=CC=CC=C2C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H21NO2/c1-23(2)15-9-8-14-22(16-17-10-4-3-5-11-17)20(24)18-12-6-7-13-19(18)21(22)25/h3-7,10-13H,14-16H2,1-2H3