N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]naphthalene-2-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]naphthalene-2-carboxamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]naphthalene-2-carboxamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-naphthamide Formula: C28H28N3O+ MolecularWeight: 422.54142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H27N3O/c32-28(25-11-10-23-8-4-5-9-24(23)20-25)29-26-12-14-27(15-13-26)31-18-16-30(17-19-31)21-22-6-2-1-3-7-22/h1-15,20H,16-19,21H2,(H,29,32)/p+1