N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-phenylmethoxybenzamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O2/c1-2-28-15-17-29(18-16-28)24-13-11-23(12-14-24)27-26(30)22-9-6-10-25(19-22)31-20-21-7-4-3-5-8-21/h3-14,19H,2,15-18,20H2,1H3,(H,27,30)/p+1