(E)-3-(4-tert-butylphenyl)-1-[4-(diphenylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-tert-butylphenyl)-1-[4-(diphenylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzhydrylpiperazin-1-yl)-3-(4-tert-butylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-tert-butylphenyl)-1-[4-(diphenylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-1-(4-benzhydrylpiperazin-1-yl)-3-(4-tert-butylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzhydrylpiperazino)-3-(4-tert-butylphenyl)prop-2-en-1-one Formula: C30H34N2O MolecularWeight: 438.60376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H34N2O/c1-30(2,3)27-17-14-24(15-18-27)16-19-28(33)31-20-22-32(23-21-31)29(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-19,29H,20-23H2,1-3H3/b19-16+