methyl 2-[2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)propanoylamino]benzoate

Systemtic Name: methyl 2-[2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)propanoylamino]benzoate Openeye Name: methyl 2-[2-(4-methyl-2-oxo-pyrimido[1,2-b]indazol-6-yl)propanoylamino]benzoate CAS Name: 2-[[2-(4-methyl-2-oxo-6-pyrimido[1,2-b]indazolyl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6-yl)propanoylamino]benzoate Traditional Name: 2-[2-(2-keto-4-methyl-pyrimid[1,2-b]indazol-6-yl)propanoylamino]benzoic acid methyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)C(C)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC(=O)N=C2N1N(C3=CC=CC=C32)C(C)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C22H20N4O4/c1-13-12-19(27)24-20-16-9-5-7-11-18(16)26(25(13)20)14(2)21(28)23-17-10-6-4-8-15(17)22(29)30-3/h4-12,14H,1-3H3,(H,23,28)