ethanedioic acid; 1-(4-methoxyphenyl)sulfonyl-4-(4-phenylbutan-2-yl)piperazine

Systemtic Name: ethanedioic acid; 1-(4-methoxyphenyl)sulfonyl-4-(4-phenylbutan-2-yl)piperazine Openeye Name: 1-(4-methoxyphenyl)sulfonyl-4-(1-methyl-3-phenyl-propyl)piperazine; oxalic acid CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-(4-phenylbutan-2-yl)piperazine; oxalic acid IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-4-(4-phenylbutan-2-yl)piperazine; oxalic acid Traditional Name: 1-(4-methoxyphenyl)sulfonyl-4-(1-methyl-3-phenyl-propyl)piperazine; oxalic acid Formula: C23H30N2O7S MolecularWeight: 478.5585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CCC1=CC=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H28N2O3S.C2H2O4/c1-18(8-9-19-6-4-3-5-7-19)22-14-16-23(17-15-22)27(24,25)21-12-10-20(26-2)11-13-21;3-1(4)2(5)6/h3-7,10-13,18H,8-9,14-17H2,1-2H3;(H,3,4)(H,5,6)