4-[(E)-1-(2-azanyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-6-yl)prop-1-en-2-yl]benzoic acid

Systemtic Name: 4-[(E)-1-(2-azanyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-6-yl)prop-1-en-2-yl]benzoic acid Openeye Name: 4-[(E)-2-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)-1-methyl-vinyl]benzoic acid CAS Name: 4-[(E)-1-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)prop-1-en-2-yl]benzoic acid IUPAC Name: 4-[(E)-1-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)prop-1-en-2-yl]benzoic acid Traditional Name: 4-[(E)-2-(2-amino-4-keto-1H-pyrido[2,3-d]pyrimidin-6-yl)-1-methyl-vinyl]benzoic acid Formula: C17H14N4O3 MolecularWeight: 322.31806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CN=C2C(=C1)C(=O)N=C(N2)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C/C(=C\C1=CN=C2C(=C1)C(=O)N=C(N2)N)/C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H14N4O3/c1-9(11-2-4-12(5-3-11)16(23)24)6-10-7-13-14(19-8-10)20-17(18)21-15(13)22/h2-8H,1H3,(H,23,24)(H3,18,19,20,21,22)/b9-6+