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

Systemtic Name: 3-methoxy-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]naphthalene-2-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 3-methoxy-N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-methoxy-2-naphthamide Formula: C29H30N3O2+ MolecularWeight: 452.5674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H29N3O2/c1-34-28-20-24-10-6-5-9-23(24)19-27(28)29(33)30-25-11-13-26(14-12-25)32-17-15-31(16-18-32)21-22-7-3-2-4-8-22/h2-14,19-20H,15-18,21H2,1H3,(H,30,33)/p+1