4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenethyl-phthalazine-1-carboxamide

Systemtic Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenethyl-phthalazine-1-carboxamide Openeye Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenethyl-phthalazine-1-carboxamide CAS Name: 4-[4-(4-methoxyphenyl)-1-piperazinyl]-N-phenethyl-1-phthalazinecarboxamide IUPAC Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenethylphthalazine-1-carboxamide Traditional Name: 4-[4-(4-methoxyphenyl)piperazino]-N-phenethyl-phthalazine-1-carboxamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C28H29N5O2/c1-35-23-13-11-22(12-14-23)32-17-19-33(20-18-32)27-25-10-6-5-9-24(25)26(30-31-27)28(34)29-16-15-21-7-3-2-4-8-21/h2-14H,15-20H2,1H3,(H,29,34)