[4-(2-phenoxyethyl)piperazin-1-yl]-(4-piperidin-1-ylphthalazin-1-yl)methanone

Systemtic Name: [4-(2-phenoxyethyl)piperazin-1-yl]-(4-piperidin-1-ylphthalazin-1-yl)methanone Openeye Name: [4-(2-phenoxyethyl)piperazin-1-yl]-[4-(1-piperidyl)phthalazin-1-yl]methanone CAS Name: [4-(2-phenoxyethyl)-1-piperazinyl]-[4-(1-piperidinyl)-1-phthalazinyl]methanone IUPAC Name: [4-(2-phenoxyethyl)piperazin-1-yl]-(4-piperidin-1-ylphthalazin-1-yl)methanone Traditional Name: [4-(2-phenoxyethyl)piperazino]-(4-piperidinophthalazin-1-yl)methanone Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(C3=CC=CC=C32)C(=O)N4CCN(CC4)CCOC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NN=C(C3=CC=CC=C32)C(=O)N4CCN(CC4)CCOC5=CC=CC=C5

InChI

InChI=1S/C26H31N5O2/c32-26(31-17-15-29(16-18-31)19-20-33-21-9-3-1-4-10-21)24-22-11-5-6-12-23(22)25(28-27-24)30-13-7-2-8-14-30/h1,3-6,9-12H,2,7-8,13-20H2