3-ethoxy-4-[[2-oxidanyl-3-[[3-(piperidin-1-ylmethyl)phenyl]methoxy]propyl]amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-ethoxy-4-[[2-oxidanyl-3-[[3-(piperidin-1-ylmethyl)phenyl]methoxy]propyl]amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-ethoxy-4-[[2-hydroxy-3-[[3-(1-piperidylmethyl)phenyl]methoxy]propyl]amino]cyclobut-3-ene-1,2-dione CAS Name: 3-ethoxy-4-[[2-hydroxy-3-[[3-(1-piperidinylmethyl)phenyl]methoxy]propyl]amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-ethoxy-4-[[2-hydroxy-3-[[3-(piperidin-1-ylmethyl)phenyl]methoxy]propyl]amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-ethoxy-4-[[2-hydroxy-3-[3-(piperidinomethyl)benzyl]oxy-propyl]amino]cyclobut-3-ene-1,2-quinone Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C1=O)NCC(COCC2=CC=CC(=C2)CN3CCCCC3)O

Isomeric SMILES

CCOC1=C(C(=O)C1=O)NCC(COCC2=CC=CC(=C2)CN3CCCCC3)O

InChI

InChI=1S/C22H30N2O5/c1-2-29-22-19(20(26)21(22)27)23-12-18(25)15-28-14-17-8-6-7-16(11-17)13-24-9-4-3-5-10-24/h6-8,11,18,23,25H,2-5,9-10,12-15H2,1H3