2-[4-[(Z)-C-methyl-N-(phthalazin-1-ylamino)carbonimidoyl]phenoxy]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[(Z)-C-methyl-N-(phthalazin-1-ylamino)carbonimidoyl]phenoxy]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[(Z)-C-methyl-N-(phthalazin-1-ylamino)carbonimidoyl]phenoxy]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(1Z)-1-(1-phthalazinylhydrazinylidene)ethyl]phenoxy]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[(Z)-C-methyl-N-(phthalazin-1-ylamino)carbonimidoyl]phenoxy]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[(Z)-C-methyl-N-(phthalazin-1-ylamino)carbonimidoyl]phenoxy]-1-pyrrolidino-ethanone Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NN=CC2=CC=CC=C21)C3=CC=C(C=C3)OCC(=O)N4CCCC4

Isomeric SMILES

C/C(=N/NC1=NN=CC2=CC=CC=C21)/C3=CC=C(C=C3)OCC(=O)N4CCCC4

InChI

InChI=1S/C22H23N5O2/c1-16(24-26-22-20-7-3-2-6-18(20)14-23-25-22)17-8-10-19(11-9-17)29-15-21(28)27-12-4-5-13-27/h2-3,6-11,14H,4-5,12-13,15H2,1H3,(H,25,26)/b24-16-