3-azanyl-4-[3-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-azanyl-4-[3-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[3-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]propylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[3-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]propylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[3-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[3-[[4-(piperidinomethyl)-2-pyridyl]oxy]propylamino]cyclobut-3-ene-1,2-quinone Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=NC=C2)OCCCNC3=C(C(=O)C3=O)N

Isomeric SMILES

C1CCN(CC1)CC2=CC(=NC=C2)OCCCNC3=C(C(=O)C3=O)N

InChI

InChI=1S/C18H24N4O3/c19-15-16(18(24)17(15)23)21-6-4-10-25-14-11-13(5-7-20-14)12-22-8-2-1-3-9-22/h5,7,11,21H,1-4,6,8-10,12,19H2