3-(benzimidazol-1-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-(benzimidazol-1-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-(benzimidazol-1-yl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-(1-benzimidazolyl)-1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-(benzimidazol-1-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-(benzimidazol-1-yl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propan-1-one Formula: C25H27N4O+ MolecularWeight: 399.50808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)CCN4C=NC5=CC=CC=C54

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)CCN4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H26N4O/c30-25(12-13-29-19-26-23-10-3-4-11-24(23)29)28-16-14-27(15-17-28)18-21-8-5-7-20-6-1-2-9-22(20)21/h1-11,19H,12-18H2/p+1