3-[[4-(diphenylmethyl)piperazin-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[4-(diphenylmethyl)piperazin-1-yl]methyl]benzoic acid Openeye Name: 3-[(4-benzhydrylpiperazin-1-yl)methyl]benzoic acid CAS Name: 3-[[4-(diphenylmethyl)-1-piperazinyl]methyl]benzoic acid IUPAC Name: 3-[(4-benzhydrylpiperazin-1-yl)methyl]benzoic acid Traditional Name: 3-[(4-benzhydrylpiperazino)methyl]benzoic acid Formula: C25H26N2O2 MolecularWeight: 386.48614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C(=O)O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C(=O)O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O2/c28-25(29)23-13-7-8-20(18-23)19-26-14-16-27(17-15-26)24(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,18,24H,14-17,19H2,(H,28,29)