N-(4-oxidanylcyclohexyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(4-oxidanylcyclohexyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(4-hydroxycyclohexyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(4-hydroxycyclohexyl)-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(4-hydroxycyclohexyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(4-hydroxycyclohexyl)-4-keto-phthalazine-1-carboxamide Formula: C22H23N3O3 MolecularWeight: 377.43632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)O

InChI

InChI=1S/C22H23N3O3/c26-17-12-10-16(11-13-17)23-21(27)20-18-8-4-5-9-19(18)22(28)25(24-20)14-15-6-2-1-3-7-15/h1-9,16-17,26H,10-14H2,(H,23,27)