(3-bromanyl-4-prop-2-enoxy-phenyl)-[4-(diphenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-prop-2-enoxy-phenyl)-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-allyloxy-3-bromo-phenyl)-(4-benzhydrylpiperazin-1-yl)methanone CAS Name: (3-bromo-4-prop-2-enoxyphenyl)-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(3-bromo-4-prop-2-enoxyphenyl)methanone Traditional Name: (4-allyloxy-3-bromo-phenyl)-(4-benzhydrylpiperazino)methanone Formula: C27H27BrN2O2 MolecularWeight: 491.41948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C27H27BrN2O2/c1-2-19-32-25-14-13-23(20-24(25)28)27(31)30-17-15-29(16-18-30)26(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h2-14,20,26H,1,15-19H2