2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)azaniumyl]ethanoate

Systemtic Name: 2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)azaniumyl]ethanoate Openeye Name: 2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)ammonio]acetate CAS Name: 2-[(5,6-diphenyl-4-furo[2,3-d]pyrimidinyl)ammonio]acetate IUPAC Name: 2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)azaniumyl]acetate Traditional Name: 2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)ammonio]acetate Formula: C20H15N3O3 MolecularWeight: 345.3514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=NC=NC(=C23)[NH2+]CC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=NC=NC(=C23)[NH2+]CC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O3/c24-15(25)11-21-19-17-16(13-7-3-1-4-8-13)18(14-9-5-2-6-10-14)26-20(17)23-12-22-19/h1-10,12H,11H2,(H,24,25)(H,21,22,23)