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

Systemtic Name: 3-azanyl-4-[3-[4-(pyrrolidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[3-[[4-(pyrrolidin-1-ylmethyl)-2-pyridyl]oxy]propylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[3-[[4-(1-pyrrolidinylmethyl)-2-pyridinyl]oxy]propylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[3-[4-(pyrrolidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[3-[[4-(pyrrolidinomethyl)-2-pyridyl]oxy]propylamino]cyclobut-3-ene-1,2-quinone Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=NC=C2)OCCCNC3=C(C(=O)C3=O)N

Isomeric SMILES

C1CCN(C1)CC2=CC(=NC=C2)OCCCNC3=C(C(=O)C3=O)N

InChI

InChI=1S/C17H22N4O3/c18-14-15(17(23)16(14)22)20-5-3-9-24-13-10-12(4-6-19-13)11-21-7-1-2-8-21/h4,6,10,20H,1-3,5,7-9,11,18H2