5,6-bis(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)furo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-bis(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)furo[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-bis(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)furo[2,3-d]pyrimidin-4-amine CAS Name: 5,6-bis(4-methoxyphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-4-furo[2,3-d]pyrimidinamine IUPAC Name: 5,6-bis(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)furo[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-bis(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-yl]-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C27H31N4O4+ MolecularWeight: 475.55944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC3=NC=NC(=C23)NCCC[NH+]4CCOCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC3=NC=NC(=C23)NCCC[NH+]4CCOCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H30N4O4/c1-32-21-8-4-19(5-9-21)23-24-26(28-12-3-13-31-14-16-34-17-15-31)29-18-30-27(24)35-25(23)20-6-10-22(33-2)11-7-20/h4-11,18H,3,12-17H2,1-2H3,(H,28,29,30)/p+1