[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-[(E)-styryl]sulfonyl-4-piperidyl]methanone CAS Name: [1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-[(E)-styryl]sulfonyl-4-piperidyl]methanone Formula: C25H31N3O3S MolecularWeight: 453.59694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3S/c29-25(27-18-16-26(17-19-27)21-23-9-5-2-6-10-23)24-11-14-28(15-12-24)32(30,31)20-13-22-7-3-1-4-8-22/h1-10,13,20,24H,11-12,14-19,21H2/b20-13+