[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C16H14N6O2 MolecularWeight: 322.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C=CC(=O)OCC3=NC(=NC(=N3)N)N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)/C=C/C(=O)OCC3=NC(=NC(=N3)N)N)N=CC=C2

InChI

InChI=1S/C16H14N6O2/c17-15-20-12(21-16(18)22-15)9-24-13(23)7-6-11-4-1-3-10-5-2-8-19-14(10)11/h1-8H,9H2,(H4,17,18,20,21,22)/b7-6+