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

Systemtic Name: N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-phenylmethoxybenzamide IUPAC Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C26H29ClN3O2+ MolecularWeight: 450.98036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28ClN3O2/c1-2-29-13-15-30(16-14-29)25-12-11-22(18-24(25)27)28-26(31)21-9-6-10-23(17-21)32-19-20-7-4-3-5-8-20/h3-12,17-18H,2,13-16,19H2,1H3,(H,28,31)/p+1