2-[1-(3-imidazol-1-ylpropylamino)ethylidene]indene-1,3-dione

Systemtic Name: 2-[1-(3-imidazol-1-ylpropylamino)ethylidene]indene-1,3-dione Openeye Name: 2-[1-(3-imidazol-1-ylpropylamino)ethylidene]indane-1,3-dione CAS Name: 2-[1-[3-(1-imidazolyl)propylamino]ethylidene]indene-1,3-dione IUPAC Name: 2-[1-(3-imidazol-1-ylpropylamino)ethylidene]indene-1,3-dione Traditional Name: 2-[1-(3-imidazol-1-ylpropylamino)ethylidene]indane-1,3-quinone Formula: C17H17N3O2 MolecularWeight: 295.33578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)C2=CC=CC=C2C1=O)NCCCN3C=CN=C3

Isomeric SMILES

CC(=C1C(=O)C2=CC=CC=C2C1=O)NCCCN3C=CN=C3

InChI

InChI=1S/C17H17N3O2/c1-12(19-7-4-9-20-10-8-18-11-20)15-16(21)13-5-2-3-6-14(13)17(15)22/h2-3,5-6,8,10-11,19H,4,7,9H2,1H3