2-[(4-naphthalen-2-ylpiperazin-1-yl)carbonylamino]benzoic acid

Systemtic Name: 2-[(4-naphthalen-2-ylpiperazin-1-yl)carbonylamino]benzoic acid Openeye Name: 2-[[4-(2-naphthyl)piperazine-1-carbonyl]amino]benzoic acid CAS Name: 2-[[[4-(2-naphthalenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[(4-naphthalen-2-ylpiperazine-1-carbonyl)amino]benzoic acid Traditional Name: 2-[[4-(2-naphthyl)piperazine-1-carbonyl]amino]benzoic acid Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=CC=CC=C3C=C2)C(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC3=CC=CC=C3C=C2)C(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H21N3O3/c26-21(27)19-7-3-4-8-20(19)23-22(28)25-13-11-24(12-14-25)18-10-9-16-5-1-2-6-17(16)15-18/h1-10,15H,11-14H2,(H,23,28)(H,26,27)