3-[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1H-benzimidazol-2-yl]butanoate

Systemtic Name: 3-[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1H-benzimidazol-2-yl]butanoate Openeye Name: 3-[6-[(4-benzhydrylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]butanoate CAS Name: 3-[6-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1H-benzimidazol-2-yl]butanoate IUPAC Name: 3-[6-[(4-benzhydrylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]butanoate Traditional Name: 3-[6-[(4-benzhydrylpiperazino)methyl]-1H-benzimidazol-2-yl]butyrate Formula: C29H31N4O2- MolecularWeight: 467.58204

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)[O-])C1=NC2=C(N1)C=C(C=C2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(CC(=O)[O-])C1=NC2=C(N1)C=C(C=C2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N4O2/c1-21(18-27(34)35)29-30-25-13-12-22(19-26(25)31-29)20-32-14-16-33(17-15-32)28(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-13,19,21,28H,14-18,20H2,1H3,(H,30,31)(H,34,35)/p-1