1-[4-(4-tert-butylphenyl)piperazin-1-yl]-4-(phenylmethyl)phthalazine

Systemtic Name: 1-[4-(4-tert-butylphenyl)piperazin-1-yl]-4-(phenylmethyl)phthalazine Openeye Name: 1-benzyl-4-[4-(4-tert-butylphenyl)piperazin-1-yl]phthalazine CAS Name: 1-[4-(4-tert-butylphenyl)-1-piperazinyl]-4-(phenylmethyl)phthalazine IUPAC Name: 1-benzyl-4-[4-(4-tert-butylphenyl)piperazin-1-yl]phthalazine Traditional Name: 1-benzyl-4-[4-(4-tert-butylphenyl)piperazino]phthalazine Formula: C29H32N4 MolecularWeight: 436.59118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H32N4/c1-29(2,3)23-13-15-24(16-14-23)32-17-19-33(20-18-32)28-26-12-8-7-11-25(26)27(30-31-28)21-22-9-5-4-6-10-22/h4-16H,17-21H2,1-3H3