3-[3-[6-(diethylaminomethyl)pyridin-2-yl]oxypropylamino]-4-methoxy-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[3-[6-(diethylaminomethyl)pyridin-2-yl]oxypropylamino]-4-methoxy-cyclobut-3-ene-1,2-dione Openeye Name: 3-[3-[[6-(diethylaminomethyl)-2-pyridyl]oxy]propylamino]-4-methoxy-cyclobut-3-ene-1,2-dione CAS Name: 3-[3-[[6-(diethylaminomethyl)-2-pyridinyl]oxy]propylamino]-4-methoxycyclobut-3-ene-1,2-dione IUPAC Name: 3-[3-[6-(diethylaminomethyl)pyridin-2-yl]oxypropylamino]-4-methoxycyclobut-3-ene-1,2-dione Traditional Name: 3-[3-[[6-(diethylaminomethyl)-2-pyridyl]oxy]propylamino]-4-methoxy-cyclobut-3-ene-1,2-quinone Formula: C18H25N3O4 MolecularWeight: 347.4088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC(=CC=C1)OCCCNC2=C(C(=O)C2=O)OC

Isomeric SMILES

CCN(CC)CC1=NC(=CC=C1)OCCCNC2=C(C(=O)C2=O)OC

InChI

InChI=1S/C18H25N3O4/c1-4-21(5-2)12-13-8-6-9-14(20-13)25-11-7-10-19-15-16(22)17(23)18(15)24-3/h6,8-9,19H,4-5,7,10-12H2,1-3H3