4-[[5,6-di(propan-2-yl)-1,2,4-triazin-3-yl]carbamoyl]benzoic acid

Systemtic Name: 4-[[5,6-di(propan-2-yl)-1,2,4-triazin-3-yl]carbamoyl]benzoic acid Openeye Name: 4-[(5,6-diisopropyl-1,2,4-triazin-3-yl)carbamoyl]benzoic acid CAS Name: 4-[[[5,6-di(propan-2-yl)-1,2,4-triazin-3-yl]amino]-oxomethyl]benzoic acid IUPAC Name: 4-[[5,6-di(propan-2-yl)-1,2,4-triazin-3-yl]carbamoyl]benzoic acid Traditional Name: 4-[(5,6-diisopropyl-1,2,4-triazin-3-yl)carbamoyl]benzoic acid Formula: C17H20N4O3 MolecularWeight: 328.3657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=NC(=N1)NC(=O)C2=CC=C(C=C2)C(=O)O)C(C)C

Isomeric SMILES

CC(C)C1=C(N=NC(=N1)NC(=O)C2=CC=C(C=C2)C(=O)O)C(C)C

InChI

InChI=1S/C17H20N4O3/c1-9(2)13-14(10(3)4)20-21-17(18-13)19-15(22)11-5-7-12(8-6-11)16(23)24/h5-10H,1-4H3,(H,23,24)(H,18,19,21,22)