2-[2-[4-(2-hydroxyphenyl)carbonyl-4-phenyl-piperazin-4-ium-1-yl]ethylamino]benzamide

Systemtic Name: 2-[2-[4-(2-hydroxyphenyl)carbonyl-4-phenyl-piperazin-4-ium-1-yl]ethylamino]benzamide Openeye Name: 2-[2-[4-(2-hydroxybenzoyl)-4-phenyl-piperazin-4-ium-1-yl]ethylamino]benzamide CAS Name: 2-[2-[4-[(2-hydroxyphenyl)-oxomethyl]-4-phenyl-1-piperazin-4-iumyl]ethylamino]benzamide IUPAC Name: 2-[2-[4-(2-hydroxybenzoyl)-4-phenylpiperazin-4-ium-1-yl]ethylamino]benzamide Traditional Name: 2-[2-(4-phenyl-4-salicyloyl-piperazin-4-ium-1-yl)ethylamino]benzamide Formula: C26H29N4O3+ MolecularWeight: 445.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1CCNC2=CC=CC=C2C(=O)N)(C3=CC=CC=C3)C(=O)C4=CC=CC=C4O

Isomeric SMILES

C1C[N+](CCN1CCNC2=CC=CC=C2C(=O)N)(C3=CC=CC=C3)C(=O)C4=CC=CC=C4O

InChI

InChI=1S/C26H28N4O3/c27-25(32)21-10-4-6-12-23(21)28-14-15-29-16-18-30(19-17-29,20-8-2-1-3-9-20)26(33)22-11-5-7-13-24(22)31/h1-13H,14-19H2,(H3-,27,28,31,32,33)/p+1